CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00103511" 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 CFAMM00103511
Family CFFAD816 Thymidylate synthase Inhibitor Leucovorin/5-fluorouracil Family
Superfamily CFSAD682 Thymidylate synthase Inhibitor Leucovorin/5-fluorouracil Superfamily
Class CFCAD617 Class 617
External ID CHEMBL436405 External Source CHEMBL
PubChem CID 44364694 Functional Category Bioactive
Molecule Name 2-[(2S)-1-[2-[[4-[[amino(dimethylamino)methylidene]amino]benzoyl]amino]acetyl]-4-(carboxymethyl)-3-oxopiperazin-2-yl]acetic acid
IUPAC Name 2-[(2S)-1-[2-[[4-[[amino(dimethylamino)methylidene]amino]benzoyl]amino]acetyl]-4-(carboxymethyl)-3-oxopiperazin-2-yl]acetic acid
Synonyms CHEBI:345104
InChi InChI=1S/C20H26N6O7/c1-24(2)20(21)23-13-5-3-12(4-6-13)18(32)22-10-15(27)26-8-7-25(11-17(30)31)19(33)14(26)9-16(28)29/h3-6,14H,7-11H2,1-2H3,(H2,21,23)(H,22,32)(H,28,29)(H,30,31)/t14-/m0/s1
Formula C20H26N6O7 Molecular Weight 462.46
Cross Link CHEMBL436405

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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