1.0 2026-04-14 20:32:09 UTC 2026-08-22 10:07:16 UTC Berotralstat SmallMolecule Berotralstat is an organic compound with the chemical formula C30H26F4N6O. Berotralstat belongs to the anilides, a subclass of benzene and substituted derivatives within the organic compounds. With an average molecular weight of 562.57 g/mol, Berotralstat is a heavy molecule. This compound acts as an inhibitor of the protein target plasma kallikrein (KLKB1). It is identified as a hematological agent used in healthcare, pharmaceuticals, and veterinary products, with oral administration as the recorded route of exposure. C30H26F4N6O 562.573 562.210422133 1809010-50-1 NCC1=CC(=CC=C1)N1N=C(C=C1C(=O)NC1=CC(=CC=C1F)[C@H](NCC1CC1)C1=CC=CC(=C1)C#N)C(F)(F)F InChI=1S/C30H26F4N6O/c31-24-10-9-22(28(37-17-18-7-8-18)21-5-1-3-19(11-21)15-35)13-25(24)38-29(41)26-14-27(30(32,33)34)39-40(26)23-6-2-4-20(12-23)16-36/h1-6,9-14,18,28,37H,7-8,16-17,36H2,(H,38,41)/t28-/m1/s1 UXNXMBYCBRBRFD-MUUNZHRXSA-N Detected and Not Quantified Berotralstat Drug Metabolism Action Pathway SMP0145282 logp 5.58 average_mass 562.573 ChemAxon mono_mass 562.210422133 ChemAxon smiles NCC1=CC(=CC=C1)N1N=C(C=C1C(=O)NC1=CC(=CC=C1F)[C@H](NCC1CC1)C1=CC=CC(=C1)C#N)C(F)(F)F ChemAxon formula C30H26F4N6O ChemAxon inchi InChI=1S/C30H26F4N6O/c31-24-10-9-22(28(37-17-18-7-8-18)21-5-1-3-19(11-21)15-35)13-25(24)38-29(41)26-14-27(30(32,33)34)39-40(26)23-6-2-4-20(12-23)16-36/h1-6,9-14,18,28,37H,7-8,16-17,36H2,(H,38,41)/t28-/m1/s1 ChemAxon inchikey UXNXMBYCBRBRFD-MUUNZHRXSA-N ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f72a8bc51e8> DB15982 137528262 BE0002440