CFam Chemical Families Database
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You are searching for "CFAMM00393727" in compound.

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CFAM Mol ID CFAMM00393727
Family CFFBM9210 Cystic fibrosis transmembrane conductance regulator inhibitor (3S)-2-[3-(2-methylpropoxy)benzoyl]-N-(4-pentylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide family
Superfamily CFSBM347 Cathepsin K and Cathepsin L1 Binder Superfamily 2
Class CFCID1067 Class 2417
External ID 54490947 External Source PubChem
PubChem CID 54490947 Functional Category Patent Compound
Molecule Name AGN-PC-0A9HZN
IUPAC Name tert-butyl 1-[4-[[7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carbonyl]amino]benzoyl]piperidin-1-ium-1-carboxylate
Synonyms tert-butyl 1-[4-[[7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carbonyl]amino]benzoyl]piperidin-1-ium-1-carboxylate
InChi InChI=1S/C35H38N2O5/c1-24-8-10-25(11-9-24)27-14-17-31-29(22-27)23-28(18-21-41-31)32(38)36-30-15-12-26(13-16-30)33(39)37(19-6-5-7-20-37)34(40)42-35(2,3)4/h8-17,22-23H,5-7,18-21H2,1-4H3/p+1
Formula C35H39N2O5+ Molecular Weight 567.69
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Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

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