lenvatinib   Click here for help

GtoPdb Ligand ID: 7426

Synonyms: E 7080 | ER-203492-00 | Kisplyx® | Lenvima®
Approved drug PDB Ligand
lenvatinib is an approved drug (FDA & EMA (2015))
Compound class: Synthetic organic
Comment: Lenvatinib is a potent inhibitor of VEGFR-2 (KDR) and VEGFR-3 (FLT4) [2].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 8
Topological polar surface area 115.57
Molecular weight 426.11
XLogP 2.47
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES COc1cc2nccc(c2cc1C(=O)N)Oc1ccc(c(c1)Cl)NC(=O)NC1CC1
Isomeric SMILES COc1cc2nccc(c2cc1C(=O)N)Oc1ccc(c(c1)Cl)NC(=O)NC1CC1
InChI InChI=1S/C21H19ClN4O4/c1-29-19-10-17-13(9-14(19)20(23)27)18(6-7-24-17)30-12-4-5-16(15(22)8-12)26-21(28)25-11-2-3-11/h4-11H,2-3H2,1H3,(H2,23,27)(H2,25,26,28)
InChI Key WOSKHXYHFSIKNG-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA & EMA (2015))
IUPAC Name Click here for help
4-[3-chloro-4-(cyclopropylcarbamoylamino)phenoxy]-7-methoxyquinoline-6-carboxamide
International Nonproprietary Names Click here for help
INN number INN
9361 lenvatinib
Synonyms Click here for help
E 7080 | ER-203492-00 | Kisplyx® | Lenvima®
Database Links Click here for help
Specialist databases
Reactome Drug Reactome logo R-ALL-2023393
Reactome Reaction Reactome logo R-HSA-2077420, R-HSA-9669854, R-HSA-9669900, R-HSA-9674430, R-HSA-9674095, R-HSA-2077424
Other databases
CAS Registry No. 417716-92-8 (source: Scifinder)
ChEMBL Ligand CHEMBL1289601
DrugCentral Ligand 4942
GtoPdb PubChem SID 178103998
PubChem CID 9823820
RCSB PDB Ligand LEV
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Search UniChem for chemical match using the InChIKey WOSKHXYHFSIKNG-UHFFFAOYSA-N
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SynPHARM 79689 (in complex with kinase insert domain receptor)
Wikipedia Lenvatinib