<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-04-14 18:33:34 UTC</creation_date>
  <update_date>2026-08-22 07:46:33 UTC</update_date>
  <accession/>
  <common_name>Nirogacestat</common_name>
  <class>SmallMolecule</class>
  <description>Nirogacestat is an organic compound with the chemical formula $\text{C}_{27}\text{H}_{41}\text{F}_2\text{N}_5\text{O}$ and an average molecular weight of 489.66 g/mol. Nirogacestat belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds.

This compound is identified as an antineoplastic agent within the category of healthcare, pharmaceuticals, and veterinary products. It is administered via the oral exposure route. In terms of its biological activity, Nirogacestat acts as an inhibitor or modulator of six recorded protein targets. These targets include Presenilin-1 (PSEN1), Presenilin-2 (PSEN2), Gamma-secretase subunit APH-1A (APH1A), and Gamma-secretase subunit PEN-2 (PSENEN), as well as two additional proteins.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C27H41F2N5O</chemical_formula>
  <average_molecular_weight>489.656</average_molecular_weight>
  <monisotopic_moleculate_weight>489.327917286</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>1290543-63-3</cas_registry_number>
  <smiles>CCC[C@H](N[C@H]1CCC2=CC(F)=CC(F)=C2C1)C(=O)NC1=CN(C=N1)C(C)(C)CNCC(C)(C)C</smiles>
  <inchi>InChI=1S/C27H41F2N5O/c1-7-8-23(32-20-10-9-18-11-19(28)12-22(29)21(18)13-20)25(35)33-24-14-34(17-31-24)27(5,6)16-30-15-26(2,3)4/h11-12,14,17,20,23,30,32H,7-10,13,15-16H2,1-6H3,(H,33,35)/t20-,23-/m0/s1</inchi>
  <inchikey>VFCRKLWBYMDAED-REWPJTCUSA-N</inchikey>
  <taxonomy>
    <kingdom/>
    <super_class/>
    <class/>
    <sub_class/>
    <direct_parent/>
    <alternate_parents/>
    <substituents/>
    <molecular_framework/>
    <descriptors/>
  </taxonomy>
  <status>Detected and Not Quantified</status>
  <origin/>
  <cellular_locations/>
  <biofluid_locations/>
  <tissue_locations/>
  <pathways/>
  <state/>
  <appearance/>
  <experimental_properties>
    <property>
      <kind>logp</kind>
      <value>5.5</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>489.656</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>489.327917286</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>CCC[C@H](N[C@H]1CCC2=CC(F)=CC(F)=C2C1)C(=O)NC1=CN(C=N1)C(C)(C)CNCC(C)(C)C</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C27H41F2N5O</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C27H41F2N5O/c1-7-8-23(32-20-10-9-18-11-19(28)12-22(29)21(18)13-20)25(35)33-24-14-34(17-31-24)27(5,6)16-30-15-26(2,3)4/h11-12,14,17,20,23,30,32H,7-10,13,15-16H2,1-6H3,(H,33,35)/t20-,23-/m0/s1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>VFCRKLWBYMDAED-REWPJTCUSA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
  <route_of_exposure/>
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  <metabolism/>
  <toxicity/>
  <lethaldose/>
  <carcinogenicity/>
  <use_source/>
  <min_risk_level/>
  <health_effects>#&lt;HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3baf239118&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id>DB12005</drugbank_id>
  <hmdb_id/>
  <pubchem_compound_id>46224413</pubchem_compound_id>
  <chembl_id/>
  <chemspider_id/>
  <kegg_id/>
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  <chebi_id/>
  <biocyc_id/>
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  <wikipidia/>
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</compound>
