CFam Chemical Families Database
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You are searching for "CFAMM00310335" in compound.

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CFAM Mol ID CFAMM00310335
Family CFFBM328 Beta-secretase 1 and Cathepsin D inhibitor 3ixk family
Superfamily CFSBM203 Beta-secretase 1 and Beta-secretase 2 Binder Superfamily
Class CFCBM78 Class 3128
External ID CHEMBL601521 External Source CHEMBL
PubChem CID 46233613 Functional Category Bioactive
Molecule Name 3-N-[(2R,5R)-6-[[(2S)-1-(benzylamino)-3-methyl-1-oxobutan-2-yl]amino]-1-(3,5-difluorophenoxy)-5-methoxy-6-oxohexan-2-yl]-5-[methyl(methylsulfonyl)amino]-1-N-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide
IUPAC Name 3-N-[(2R,5R)-6-[[(2S)-1-(benzylamino)-3-methyl-1-oxobutan-2-yl]amino]-1-(3,5-difluorophenoxy)-5-methoxy-6-oxohexan-2-yl]-5-[methyl(methylsulfonyl)amino]-1-N-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide
Synonyms CHEBI:704448
InChi InChI=1S/C43H51F2N5O8S/c1-27(2)39(43(54)46-25-29-13-9-7-10-14-29)49-42(53)38(57-5)18-17-35(26-58-37-23-33(44)22-34(45)24-37)48-41(52)32-19-31(20-36(21-32)50(4)59(6,55)56)40(51)47-28(3)30-15-11-8-12-16-30/h7-16,19-24,27-28,35,38-39H,17-18,25-26H2,1-6H3,(H,46,54)(H,47,51)(H,48,52)(H,49,53)/t28-,35-,38-,39+/m1/s1
Formula C43H51F2N5O8S Molecular Weight 835.96
Cross Link CHEMBL601521

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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