famitinib   Click here for help

GtoPdb Ligand ID: 7886

Synonyms: compound 9 [PMID: 21028894] | SHR 1020 | SHR-1020 | SHR1020
Compound class: Synthetic organic
Comment: Famitinib is a multi-targeted receptor tyrosine kinase inhibitor [1]. The compound is a structural analogue of sunitinib.
The INN famitinib appeared in Proposed List 125 which was published by the WHO at the end of July 2021.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 68.44
Molecular weight 410.21
XLogP 2.59
No. Lipinski's rules broken 0
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Canonical SMILES CCN(CCN1CCc2c(C1=O)c(C)c([nH]2)C=C1C(=O)Nc2c1cc(F)cc2)CC
Isomeric SMILES CCN(CCN1CCc2c(C1=O)c(C)c([nH]2)/C=C/1\C(=O)Nc2c1cc(F)cc2)CC
InChI InChI=1S/C23H27FN4O2/c1-4-27(5-2)10-11-28-9-8-19-21(23(28)30)14(3)20(25-19)13-17-16-12-15(24)6-7-18(16)26-22(17)29/h6-7,12-13,25H,4-5,8-11H2,1-3H3,(H,26,29)/b17-13-
1. Cho TP, Dong SY, Jun F, Hong FJ, Liang YJ, Lu X, Hua PJ, Li LY, Lei Z, Bing H et al.. (2010)
Novel potent orally active multitargeted receptor tyrosine kinase inhibitors: synthesis, structure-activity relationships, and antitumor activities of 2-indolinone derivatives.
J Med Chem, 53 (22): 8140-9. [PMID:21028894]