CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00416144" in compound.

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CFAM Mol ID CFAMM00416144
Family CFFBM12498 Beta-secretase 1 and Cathepsin B inhibitor SureCN4666465 family
Superfamily CFSBM581 Beta-secretase 1 and Cathepsin D Binder Superfamily
Class CFCAD168 Class 168
External ID CHEMBL253800 External Source CHEMBL
PubChem CID 10146435 Functional Category Bioactive
Molecule Name SureCN14201569
IUPAC Name benzyl N-[3-heptan-4-ylsulfonyl-1-[[(2S,3R)-3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]amino]-1-oxopropan-2-yl]carbamate
Synonyms CHEBI:519742
InChi InChI=1S/C36H49N3O7S/c1-4-13-31(14-5-2)47(43,44)26-33(39-36(42)46-25-28-17-10-7-11-18-28)35(41)38-32(22-27-15-8-6-9-16-27)34(40)24-37-23-29-19-12-20-30(21-29)45-3/h6-12,15-21,31-34,37,40H,4-5,13-14,22-26H2,1-3H3,(H,38,41)(H,39,42)/t32-,33?,34+/m0/s1
Formula C36H49N3O7S Molecular Weight 667.86
Cross Link CHEMBL253800

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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