CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00383272" 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 CFAMM00383272
Family CFFBM7797 Nitric oxide synthase, inducible and Cytochrome P450 2D6 inhibitor SureCN6492008 family
Superfamily CFSID1468 Dipeptidyl peptidase 4 Inhibitor (2-chloro-6-phenoxyphenyl)methanamine Superfamily
Class CFCID578 Class 1928
External ID CHEMBL1762479 External Source CHEMBL
PubChem CID 54580935 Functional Category Bioactive
Molecule Name SureCN6491911
IUPAC Name 2-[(1R)-3-amino-1-phenylpropoxy]-4-chloro-5-fluorobenzonitrile;oxalic acid
Synonyms CHEBI:1239772
InChi InChI=1S/C16H14ClFN2O.C2H2O4/c17-13-9-16(12(10-20)8-14(13)18)21-15(6-7-19)11-4-2-1-3-5-11;3-1(4)2(5)6/h1-5,8-9,15H,6-7,19H2;(H,3,4)(H,5,6)/t15-;/m1./s1
Formula C18H16ClFN2O5 Molecular Weight 394.78
Cross Link CHEMBL1762479

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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