CFam Chemical Families Database
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You are searching for "CFAMM00370052" in compound.

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CFAM Mol ID CFAMM00370052
Family CFFBM6130 Renin and Cathepsin D inhibitor tert-butyl N-[(2S)-1-[[(2S)-1-[[2,2-difluoro-6-methyl-1-[[(2S,3S)-3-methyl-1-oxo-1-(pyridin-2-ylmethylamino)pentan-2-yl]amino]-1,3-dioxoheptan-4-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate family
Superfamily CFSBM690 Renin and Prothrombin Binder Superfamily
Class CFCAD639 Class 639
External ID CHEMBL254918 External Source CHEMBL
PubChem CID 44447269 Functional Category Bioactive
Molecule Name tert-butyl N-[(2R)-1-oxo-1-[[3-(1-phenylcyclopropyl)imidazo[4,5-b]pyridin-2-yl]methylamino]-3-[2-(trifluoromethyl)phenyl]propan-2-yl]carbamate
IUPAC Name tert-butyl N-[(2R)-1-oxo-1-[[3-(1-phenylcyclopropyl)imidazo[4,5-b]pyridin-2-yl]methylamino]-3-[2-(trifluoromethyl)phenyl]propan-2-yl]carbamate
Synonyms CHEBI:523717
InChi InChI=1S/C31H32F3N5O3/c1-29(2,3)42-28(41)38-24(18-20-10-7-8-13-22(20)31(32,33)34)27(40)36-19-25-37-23-14-9-17-35-26(23)39(25)30(15-16-30)21-11-5-4-6-12-21/h4-14,17,24H,15-16,18-19H2,1-3H3,(H,36,40)(H,38,41)/t24-/m1/s1
Formula C31H32F3N5O3 Molecular Weight 579.61
Cross Link CHEMBL254918

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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National University of Singapore, Singapore

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