CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00403546" in compound.

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CFAM Mol ID CFAMM00403546
Family CFFBM10667 Beta-secretase 1 and Cathepsin D inhibitor N-[4-[[(3S,4S,5R)-5-[(3-tert-butylphenyl)methylamino]-4-hydroxy-1,1-dioxothian-3-yl]methyl]-2-ethyl-6-fluorophenyl]acetamide family
Superfamily CFSBM5235 Cathepsin D and Beta-secretase 1 Binder Superfamily 6
Class CFCBM500 Class 3550
External ID CHEMBL2047893 External Source CHEMBL
PubChem CID 57385528 Functional Category Bioactive
Molecule Name (3S,4S,5R)-3-[(4-amino-3-fluoro-5-propylphenyl)methyl]-5-[(3-tert-butylphenyl)methylamino]-1,1-dioxothian-4-ol
IUPAC Name (3S,4S,5R)-3-[(4-amino-3-fluoro-5-propylphenyl)methyl]-5-[(3-tert-butylphenyl)methylamino]-1,1-dioxothian-4-ol
InChi InChI=1S/C26H37FN2O3S/c1-5-7-19-10-18(13-22(27)24(19)28)11-20-15-33(31,32)16-23(25(20)30)29-14-17-8-6-9-21(12-17)26(2,3)4/h6,8-10,12-13,20,23,25,29-30H,5,7,11,14-16,28H2,1-4H3/t20-,23+,25+/m1/s1
Formula C26H37FN2O3S Molecular Weight 476.65
Cross Link CHEMBL2047893

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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