CFam Chemical Families Database
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You are searching for "CFAMM00140742" in compound.

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CFAM Mol ID CFAMM00140742
Family CFFCD165 Tyrosine-protein kinase Lck and Aurora kinase B Inhibitor VX-680 Family
Superfamily CFSCD150 Tyrosine-protein kinase Lck and Aurora kinase B Inhibitor VX-680 Superfamily
Class CFCCD122 Class 935
External ID CHEMBL1822646 External Source CHEMBL
PubChem CID 56675312 Functional Category Bioactive
Molecule Name 2-[(2S,4R)-4-amino-2-(hydroxymethyl)pyrrolidin-1-yl]-N-[4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]sulfanylphenyl]acetamide
IUPAC Name 2-[(2S,4R)-4-amino-2-(hydroxymethyl)pyrrolidin-1-yl]-N-[4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]sulfanylphenyl]acetamide
InChi InChI=1S/C23H27N9O2S/c1-14-9-20(29-28-14)26-22-19-3-2-8-32(19)30-23(27-22)35-18-6-4-16(5-7-18)25-21(34)12-31-11-15(24)10-17(31)13-33/h2-9,15,17,33H,10-13,24H2,1H3,(H,25,34)(H2,26,27,28,29,30)/t15-,17+/m1/s1
Formula C23H27N9O2S Molecular Weight 493.58
Cross Link CHEMBL1822646

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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