Desvenlafaxine (CED0005889)

Record Information

Version

1.0

Creation Date

2016-05-25 18:29:46 UTC

Update Date

2026-05-14 18:22:59 UTC

SynCED ID

CED0005889

Secondary Accession Numbers

CHEM022356

Identification

Common Name

Desvenlafaxine

Class

Small Molecule

Description

Desvenlafaxine is an organic compound with the formula C16H25NO2 and an average molecular weight of 263.38 g/mol. Desvenlafaxine belongs to the alcohols and polyols, a subclass of organooxygen compounds within the organic compounds. This compound is found in or released from healthcare, pharmaceuticals, and veterinary products, specifically as an antidepressant, and is administered via oral exposure. It acts on three recorded protein targets, serving as an inhibitor of the sodium-dependent serotonin transporter (SLC6A4), the sodium-dependent noradrenaline transporter (SLC6A2), and the sodium-dependent dopamine transporter (SLC6A3).

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Value	Source
1-[2-(Dimethylamino)-1-(4-hydroxyphenyl)ethyl]cyclohexanol	ChEBI
4-[2-(Dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenol	ChEBI
Khedezla	Kegg
O-Desmethylvenlafaxine succinate	HMDB
4-(2-(Dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)phenol	HMDB
Succinate, desvenlafaxine	HMDB
2-(1-Hydroxycyclohexyl)-2-((4-hydroxyphenyl)ethyl)dimethylammonium 3-carboxypropanoate monohydrate	HMDB
O Desmethylvenlafaxine	HMDB
O Desmethylvenlafaxine succinate	HMDB
O-Desmethylvenlafaxine succinate monohydrate	HMDB
Succinate, O-desmethylvenlafaxine	HMDB
Desvenlafaxine succinate	HMDB
Monohydrate, O-desmethylvenlafaxine succinate	HMDB
O Desmethylvenlafaxine succinate monohydrate	HMDB
O-Desmethylvenlafaxine	HMDB
Pristiq	HMDB
Succinate monohydrate, O-desmethylvenlafaxine	HMDB
O-Desvenlafaxine	HMDB
Desvenlafaxine	ChEBI

Chemical Formula

C₁₆H₂₅NO₂

Average Molecular Mass

263.375 g/mol

Monoisotopic Mass

263.189 g/mol

CAS Registry Number

93413-62-8

IUPAC Name

4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenol

Traditional Name

desvenlafaxine

SMILES

CN(C)CC(C1=CC=C(O)C=C1)C1(O)CCCCC1

InChI Identifier

InChI=1S/C16H25NO2/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16/h6-9,15,18-19H,3-5,10-12H2,1-2H3

InChI Key

KYYIDSXMWOZKMP-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as cyclohexanols. Cyclohexanols are compounds containing an alcohol group attached to a cyclohexane ring.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Alcohols and polyols

Direct Parent

Cyclohexanols

Alternative Parents

Substituents

1-hydroxy-2-unsubstituted benzenoid
Cyclohexanol
Phenol
Aralkylamine
Monocyclic benzene moiety
Benzenoid
1,3-aminoalcohol
Cyclic alcohol
Tertiary alcohol
Tertiary amine
Tertiary aliphatic amine
Hydrocarbon derivative
Organonitrogen compound
Organopnictogen compound
Amine
Organic nitrogen compound
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic compounds

External Descriptors

tertiary amino compound (CHEBI:83527 )
phenols (CHEBI:83527 )
cyclohexanols (CHEBI:83527 )

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Property	Value	Source
Water Solubility	1.4 g/L	ALOGPS
logP	2.6	ALOGPS
logP	2.29	ChemAxon
logS	-2.3	ALOGPS
pKa (Strongest Acidic)	10.11	ChemAxon
pKa (Strongest Basic)	8.87	ChemAxon
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	3	ChemAxon
Hydrogen Donor Count	2	ChemAxon
Polar Surface Area	43.7 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	78.54 m³·mol⁻¹	ChemAxon
Polarizability	30.32 Å³	ChemAxon
Number of Rings	2	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Spectra

Spectrum Type	Description	Splash Key	Deposition Date	View
Predicted GC-MS	Predicted GC-MS Spectrum	splash10-0a4i-9110000000-bddb56f900488038ac8f	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	splash10-0ab9-9426000000-d585011517fe757dd5ff	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-03di-0090000000-90abc876cc91a398d25d	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-03y0-0960000000-0219d7d7ea1a46c8cfdf	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-014i-0900000000-529d7fb237a99866f0b4	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-03di-0090000000-ccb6c8906a1ac7d27cd6	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0002-0290000000-422a5daa0d4bf51308ef	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-001i-0910000000-03ecfc411d730c35b892	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-001i-0900000000-d0fa1892dfaae0510ee8	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-001m-0900000000-7515704132219cf15c78	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0002-0090000000-1a8bdddd358a8706e896	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-03di-0090000000-c218ef4ab652831ee930	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-06r2-4090000000-b1767a9c9c01cb43bca9	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9320000000-e38b2ae07ab3cc9b7693	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9600000000-edbb26312a47b22bffb7	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9800000000-b41801091e3c7132fec9	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9800000000-4b30d7e9d71dab81d9d7	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-03di-0090000000-5e859f484b6e3a5560c4	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-06r2-4090000000-ef1215dc6fc4eb904b90	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9310000000-dac7bd983af34469bc5f	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9600000000-8ea073e198c8a9a9a528	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9800000000-f8db755a9bb1f788394e	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9700000000-b50718dbaca8fdae5401	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0002-0090000000-7ed75e3f487ccd4f981d	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0bta-6090000000-c41286a6446e8e51aab6	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9100000000-e80f225fbf61adb457b7	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9200000000-81250c46509f91e0409b	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9400000000-b6e08db8ef3bea2640a3	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9500000000-6ece9a9beebd1cd99bfd	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9400000000-5411c26ee28734211eb5	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-03di-2090000000-134bece44509731dae98	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9150000000-383ebf283bfe27d5b20f	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-001m-0900000000-9679a4018650df8ba571	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9700000000-0f361f0c5ac4c227fbcb	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0002-0090000000-7129f32659b698878c1a	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0bta-6090000000-c41286a6446e8e51aab6	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9200000000-4c12ad8a07a86455403e	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-001m-0900000000-9f33122d2b1085597071	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-014i-0900000000-2d5dffbeba95d90f2726	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9100000000-e80f225fbf61adb457b7	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-001i-0910000000-4f5fbbb30a45e1aefb1f	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-001i-0900000000-0da75c3213abb233db9c	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0002-0190000000-c9b623bc908d7840aafe	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9320000000-de0ae0b86b051f64520e	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-06r2-4090000000-4fa31e814146e285be31	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-03di-0090000000-a4456dd551e88af669a2	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-03y0-0960000000-0219d7d7ea1a46c8cfdf	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9600000000-e5b9fba93e75db803500	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9700000000-ade424eb8e1b6b44f804	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-03di-0090000000-90abc876cc91a398d25d	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-03di-0090000000-2bcb1d0ac306f2866be3	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-001i-0900000000-1ac3194356281d919724	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-001i-0910000000-99eca01585fde2a9f082	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9800000000-0fb3f426448a8a28db99	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9600000000-2280ed706f317ffc088e	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-001m-0900000000-7515704132219cf15c78	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0002-0090000000-5d7235c8df20a3d4e1d2	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9800000000-67a6961cb4e5a2175683	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-014i-0900000000-a4c22c147e1b610db0b5	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-03di-0090000000-c218ef4ab652831ee930	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-0a4i-9320000000-2c216a46f16714149a6f	Not Available	View Spectrum
LC-MS/MS	LC-MS/MS Spectrum	splash10-06r2-4090000000-4063887a92af87ec09ce	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-01ot-0090000000-8bdd9e87d70ac30b0f4b	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0i01-3190000000-e9a4354f756616119ea4	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-1003-9030000000-d873fc36430c62fd51b9	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-03di-0090000000-3151e03b6d1268750f4e	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-03di-1390000000-6f6b5ce6a7122f629702	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-052f-9810000000-cf06f7edcabc2b491fb3	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-03di-2090000000-3dc681703755f22f0bc9	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0a4i-9010000000-221e261bccd45383b7f5	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0a4i-9100000000-9aa930c2a149b31b8a11	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-03di-0090000000-3b11cb5c5536dc01712c	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-03di-1490000000-fd2c2c00d768f2a59f02	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-006y-9840000000-29db27db9b245ec3acdc	Not Available	View Spectrum

Toxicity Profile

Toxicity Values

Toxicity Value	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Toxicity Rating	Reference
454.0 Log mg/kg [260:810]	Rat	LD50	oral	predicted	Not Available	Not Available

Toxicity / Toxin Class

Not Available

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Health Effects

Health Effect	Relationship	Direction	Description	Reference

Exposure Sources

Source ID	Source	Sector	Reference
CEDs000377	Antidepressants?Antidepressants, a class of synthetic chemicals designed to alleviate symptoms of depression and anxiety, can enter the environment through various pathways, leading to contamination of water systems.	Healthcare, pharmaceuticals & veterinary products	Not Available

Pathways

0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Sodium-dependent serotonin transporter	P31652	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.72 Applicability Domain 1.0 Statistical Significance 8.00e-05 Supporting Reference Compounds 297 E-value 0.622794
Click to view 3D structure	Alpha-1A adrenergic receptor	P43140	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.72 Applicability Domain 1.0 Statistical Significance 3.00e-05 Supporting Reference Compounds 208 E-value 0.233548
Click to view 3D structure	Norepinephrine transporter	Q9WTR4	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.662 Applicability Domain 1.0 Statistical Significance 1.40e-04 Supporting Reference Compounds 112 E-value 1.08989
Click to view 3D structure	Sodium-dependent serotonin transporter	P31645	Humans	Predicted (SEA)	Prediction Confidence Score 0.64 Applicability Domain 1.0 Statistical Significance 4.30e-04 Supporting Reference Compounds 593 E-value 3.34752
Click to view 3D structure	Sodium-dependent noradrenaline transporter	P23975	Humans	Predicted (SEA)	Prediction Confidence Score 0.64 Applicability Domain 1.0 Statistical Significance 1.90e-04 Supporting Reference Compounds 451 E-value 1.47914
Click to view 3D structure	Sodium-dependent dopamine transporter	Q01959	Humans	Predicted (SEA)	Prediction Confidence Score 0.496 Applicability Domain 1.0 Statistical Significance 0.0015 Supporting Reference Compounds 506 E-value 11.6774
Click to view 3D structure	Transporter	Q63380	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.454 Applicability Domain 0.718 Statistical Significance 2.50e-04 Supporting Reference Compounds 54 E-value 1.94623
Click to view 3D structure	Sodium-dependent dopamine transporter	P23977	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.362 Applicability Domain 0.718 Statistical Significance 0.0061 Supporting Reference Compounds 203 E-value 47.6437
Click to view 3D structure	5-hydroxytryptamine receptor 1A	P19327	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.317 Applicability Domain 0.718 Statistical Significance 0.0377 Supporting Reference Compounds 541 E-value 293.647
Click to view 3D structure	5-hydroxytryptamine receptor 2A	P14842	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.295 Applicability Domain 0.718 Statistical Significance 0.044 Supporting Reference Compounds 380 E-value 342.692
Click to view 3D structure	TyR1	H9TVJ1	Chilo suppressalis	Predicted (SEA)	Prediction Confidence Score 0.293 Applicability Domain 0.293 Low confidence Statistical Significance 1.80e-04 Supporting Reference Compounds 1 E-value 1.40129
Click to view 3D structure	5-hydroxytryptamine receptor 2A	P28223	Humans	Predicted (SEA)	Prediction Confidence Score 0.276 Applicability Domain 0.306 Statistical Significance 0.1475 Supporting Reference Compounds 955 E-value 1148.35
Click to view 3D structure	5-hydroxytryptamine receptor 6	P50406	Humans	Predicted (SEA)	Prediction Confidence Score 0.276 Applicability Domain 0.306 Statistical Significance 0.0809 Supporting Reference Compounds 536 E-value 630.112
Click to view 3D structure	5-hydroxytryptamine receptor 7	P34969	Humans	Predicted (SEA)	Prediction Confidence Score 0.276 Applicability Domain 0.306 Statistical Significance 0.0876 Supporting Reference Compounds 565 E-value 682.348
Click to view 3D structure	5-hydroxytryptamine receptor 2B	P41595	Humans	Predicted (SEA)	Prediction Confidence Score 0.276 Applicability Domain 0.306 Statistical Significance 0.1033 Supporting Reference Compounds 686 E-value 804.494
Click to view 3D structure	Estrogen receptor beta	Q92731	Humans	Predicted (SEA)	Prediction Confidence Score 0.274 Applicability Domain 0.333 Statistical Significance 0.0247 Supporting Reference Compounds 174 E-value 192.21
Click to view 3D structure	Estrogen receptor	P03372	Humans	Predicted (SEA)	Prediction Confidence Score 0.274 Applicability Domain 0.333 Statistical Significance 0.0227 Supporting Reference Compounds 201 E-value 176.406
Click to view 3D structure	Mu-type opioid receptor	P35372	Humans	Predicted (SEA)	Prediction Confidence Score 0.271 Applicability Domain 0.321 Statistical Significance 0.1225 Supporting Reference Compounds 527 E-value 953.809
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q60492	Cavia porcellus	Predicted (SEA)	Prediction Confidence Score 0.268 Applicability Domain 0.268 Low confidence Statistical Significance 0.0724 Supporting Reference Compounds 229 E-value 563.706
Click to view 3D structure	Glutamate receptor ionotropic, NMDA 2B	Q13224	Humans	Predicted (SEA)	Prediction Confidence Score 0.268 Applicability Domain 0.268 Low confidence Statistical Significance 0.0127 Supporting Reference Compounds 54 E-value 99.0242
Click to view 3D structure	Sigma intracellular receptor 2	Q5U3Y7	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.268 Applicability Domain 0.268 Low confidence Statistical Significance 0.0444 Supporting Reference Compounds 110 E-value 345.806
Click to view 3D structure	Alpha-1A adrenergic receptor	P35348	Humans	Predicted (SEA)	Prediction Confidence Score 0.267 Applicability Domain 0.268 Low confidence Statistical Significance 0.0845 Supporting Reference Compounds 376 E-value 657.748
Click to view 3D structure	Alpha-2A adrenergic receptor	P08913	Humans	Predicted (SEA)	Prediction Confidence Score 0.264 Applicability Domain 0.268 Low confidence Statistical Significance 0.1064 Supporting Reference Compounds 487 E-value 828.16
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q99720	Humans	Predicted (SEA)	Prediction Confidence Score 0.263 Applicability Domain 0.268 Low confidence Statistical Significance 0.1498 Supporting Reference Compounds 562 E-value 1166.41
Click to view 3D structure	5-hydroxytryptamine receptor 2C	P28335	Humans	Predicted (SEA)	Prediction Confidence Score 0.26 Applicability Domain 0.268 Low confidence Statistical Significance 0.1989 Supporting Reference Compounds 823 E-value 1548.34