CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00310331" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00310331
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 CHEMBL1082547 External Source CHEMBL
PubChem CID 46881696 Functional Category Bioactive
Molecule Name [3-[[(1R)-1-(4-fluorophenyl)ethyl]carbamoyl]-5-[methyl(methylsulfonyl)amino]phenyl]methyl 2-amino-2-benzyl-3-hydroxypropanoate
IUPAC Name [3-[[(1R)-1-(4-fluorophenyl)ethyl]carbamoyl]-5-[methyl(methylsulfonyl)amino]phenyl]methyl 2-amino-2-benzyl-3-hydroxypropanoate
Synonyms CHEBI:715927
InChi InChI=1S/C28H32FN3O6S/c1-19(22-9-11-24(29)12-10-22)31-26(34)23-13-21(14-25(15-23)32(2)39(3,36)37)17-38-27(35)28(30,18-33)16-20-7-5-4-6-8-20/h4-15,19,33H,16-18,30H2,1-3H3,(H,31,34)/t19-,28?/m1/s1
Formula C28H32FN3O6S Molecular Weight 557.63
Cross Link CHEMBL1082547

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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