CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00221552" 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 CFAMM00221552
Family CFFID897 Thymidylate synthase Inhibitor Sp-876 Family
Superfamily CFSID734 Thymidylate synthase Inhibitor Sp-876 Superfamily
Class CFCID516 Class 1866
External ID CHEMBL34073 External Source CHEMBL
PubChem CID 11826660 Functional Category Bioactive
Molecule Name AGN-PC-00GYNM
IUPAC Name 2-[2-[bis(carboxymethyl)amino]ethyl-[2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl]amino]acetic acid
Synonyms CTK7G1598;CHEBI:149740;AG-L-06187;({2-[bis(carboxymethyl)amino]ethyl}{2-oxo-2-[(4-sulfamoylbenzyl)amino]ethyl}amino)acetic acid;2-[2-[bis(carboxymethyl)amino]ethyl-[2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl]amino]acetic acid
InChi InChI=1S/C17H24N4O9S/c18-31(29,30)13-3-1-12(2-4-13)7-19-14(22)8-20(9-15(23)24)5-6-21(10-16(25)26)11-17(27)28/h1-4H,5-11H2,(H,19,22)(H,23,24)(H,25,26)(H,27,28)(H2,18,29,30)
Formula C17H24N4O9S Molecular Weight 460.46
Cross Link CHEMBL34073

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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