golvatinib   Click here for help

GtoPdb Ligand ID: 7956

Synonyms: E-7050 | E7050
PDB Ligand
Compound class: Synthetic organic
Comment: Golvatinib is an orally bioavailable dual kinase inhibitor of c-Met (hepatocyte growth factor receptor) and VEGFR2 (vascular endothelial growth factor receptor-2) tyrosine kinases with potential antineoplastic activity [1]. It is the first kinase inhibitor with this dual action.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 10
Hydrogen bond donors 3
Rotatable bonds 12
Topological polar surface area 119.14
Molecular weight 633.29
XLogP 3.63
No. Lipinski's rules broken 0
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Canonical SMILES CN1CCN(CC1)C1CCN(CC1)C(=O)Nc1nccc(c1)Oc1ccc(c(c1)F)NC(=O)C1(CC1)C(=O)Nc1ccc(cc1)F
Isomeric SMILES CN1CCN(CC1)C1CCN(CC1)C(=O)Nc1nccc(c1)Oc1ccc(c(c1)F)NC(=O)C1(CC1)C(=O)Nc1ccc(cc1)F
InChI InChI=1S/C33H37F2N7O4/c1-40-16-18-41(19-17-40)24-9-14-42(15-10-24)32(45)39-29-21-26(8-13-36-29)46-25-6-7-28(27(35)20-25)38-31(44)33(11-12-33)30(43)37-23-4-2-22(34)3-5-23/h2-8,13,20-21,24H,9-12,14-19H2,1H3,(H,37,43)(H,38,44)(H,36,39,45)
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
9565 golvatinib
Synonyms Click here for help
E-7050 | E7050
Database Links Click here for help
CAS Registry No. 928037-13-2
ChEMBL Ligand CHEMBL3039525
GtoPdb PubChem SID 249565639
PubChem CID 16118392
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UniChem Compound Search for chemical match using the InChIKey UQRCJCNVNUFYDX-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey UQRCJCNVNUFYDX-UHFFFAOYSA-N