motesanib   

GtoPdb Ligand ID: 5660

Synonyms: AMG 706 | AMG-706
Compound class: Synthetic organic
Comment: Motesanib is a pan-VEGFR inhibitor that was investigated for anti-tumourigenic efficacy.
2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 6
Topological polar surface area 78.94
Molecular weight 373.19
XLogP 2.99
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES O=C(c1cccnc1NCc1ccncc1)Nc1ccc2c(c1)NCC2(C)C
Isomeric SMILES O=C(c1cccnc1NCc1ccncc1)Nc1ccc2c(c1)NCC2(C)C
InChI InChI=1S/C22H23N5O/c1-22(2)14-26-19-12-16(5-6-18(19)22)27-21(28)17-4-3-9-24-20(17)25-13-15-7-10-23-11-8-15/h3-12,26H,13-14H2,1-2H3,(H,24,25)(H,27,28)
InChI Key RAHBGWKEPAQNFF-UHFFFAOYSA-N
Classification
Compound class Synthetic organic
IUPAC Name
N-(3,3-dimethyl-2,3-dihydro-1H-indol-6-yl)-2-[(pyridin-4-ylmethyl)amino]pyridine-3-carboxamide
International Nonproprietary Names
INN number INN
8828 motesanib
Synonyms
AMG 706 | AMG-706
Database Links
CAS Registry No. 453562-69-1
ChEMBL Ligand CHEMBL572881
GtoPdb PubChem SID 178102288
PubChem CID 11667893
RCSB PDB Ligand 706
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Wikipedia Motesanib