CFam Chemical Families Database
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You are searching for "CFAMM00469812" in compound.

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CFAM Mol ID CFAMM00469812
Family CFFBM24405 Receptor tyrosine-protein kinase erbB-2 and Epidermal growth factor receptor ligand N-(3-ethynylphenyl)-5-[[(2S)-morpholin-2-yl]methoxymethyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine family
Superfamily CFSBM530 Serine/threonine-protein kinase mTOR and Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform Binder Superfamily 3
Class CFCCD321 Class 1134
External ID CHEMBL247127 External Source CHEMBL
PubChem CID 44440840 Functional Category Bioactive
Molecule Name 5-[[(2S)-morpholin-2-yl]methoxymethyl]-N-[1-(pyridin-3-ylmethyl)indazol-5-yl]pyrrolo[2,1-f][1,2,4]triazin-4-amine
IUPAC Name 5-[[(2S)-morpholin-2-yl]methoxymethyl]-N-[1-(pyridin-3-ylmethyl)indazol-5-yl]pyrrolo[2,1-f][1,2,4]triazin-4-amine
Synonyms CHEBI:511908
InChi InChI=1S/C25H26N8O2/c1-2-18(11-26-6-1)14-33-23-4-3-21(10-20(23)12-29-33)31-25-24-19(5-8-32(24)30-17-28-25)15-34-16-22-13-27-7-9-35-22/h1-6,8,10-12,17,22,27H,7,9,13-16H2,(H,28,30,31)/t22-/m0/s1
InChiKey QGTJGYUQPVBUGS-QFIPXVFZSA-N
Formula C25H26N8O2 Molecular Weight 470.53
Cross Link CHEMBL247127
Structure

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).
 

Last update by

 
2014.08.29
 

 

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Professor in Department of Pharmacy
National University of Singapore, Singapore


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