CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00439936" in compound.

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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 CFAMM00439936
Family CFFBM16943 Prothrombin inhibitor [(1R)-4-carbamimidoylsulfanyl-1-[[2-[methyl(3-phenylpropanoyl)amino]acetyl]amino]butyl]boronic acid family
Superfamily CFSID21 Prothrombin and Neuromedin-K receptor Binder Superfamily
Class CFCID12 Class 1362
External ID CHEMBL423259 External Source CHEMBL
PubChem CID 44378264 Functional Category Bioactive
Molecule Name [(1R)-4-carbamimidoylsulfanyl-1-[[2-[methyl(3-phenylpropanoyl)amino]acetyl]amino]butyl]boronic acid
IUPAC Name [(1R)-4-carbamimidoylsulfanyl-1-[[2-[methyl(3-phenylpropanoyl)amino]acetyl]amino]butyl]boronic acid
Synonyms CHEBI:375289
InChi InChI=1S/C17H27BN4O4S/c1-22(16(24)10-9-13-6-3-2-4-7-13)12-15(23)21-14(18(25)26)8-5-11-27-17(19)20/h2-4,6-7,14,25-26H,5,8-12H2,1H3,(H3,19,20)(H,21,23)/t14-/m0/s1
Formula C17H27BN4O4S Molecular Weight 394.30
Cross Link CHEMBL423259

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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