SU5402   Click here for help

GtoPdb Ligand ID: 11743

Synonyms: compound 1 [PMID: 10602697] | SU-5402
PDB Ligand
Compound class: Synthetic organic
Comment: SU5402 is an inhibitor of the enzymatic activity of receptor tyrosine kinases, including kinase insert domain receptor (VEGFR-2), fibroblast growth factor receptor 1 (FGFR1) and platelet derived growth factor receptor beta (PDGFRβ) [1].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 4
Topological polar surface area 82.19
Molecular weight 296.12
XLogP 1.64
No. Lipinski's rules broken 0
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Canonical SMILES OC(=O)CCc1c([nH]cc1C)/C=C/1\C(=O)Nc2c1cccc2
Isomeric SMILES Cc1c[nH]c(c1CCC(=O)O)/C=C\1/c2ccccc2NC1=O
InChI InChI=1S/C17H16N2O3/c1-10-9-18-15(11(10)6-7-16(20)21)8-13-12-4-2-3-5-14(12)19-17(13)22/h2-5,8-9,18H,6-7H2,1H3,(H,19,22)(H,20,21)/b13-8-
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
3-[4-methyl-2-[(Z)-(2-oxo-1H-indol-3-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid
Synonyms Click here for help
compound 1 [PMID: 10602697] | SU-5402
Database Links Click here for help
BindingDB Ligand 4882
ChEMBL Ligand CHEMBL89363
DrugBank Ligand DB08577
GtoPdb PubChem SID 458923778
PubChem CID 5289418
Search Google for chemical match using the InChIKey JNDVEAXZWJIOKB-JYRVWZFOSA-N
Search Google for chemicals with the same backbone JNDVEAXZWJIOKB
UniChem Compound Search for chemical match using the InChIKey JNDVEAXZWJIOKB-JYRVWZFOSA-N
UniChem Connectivity Search for chemical match using the InChIKey JNDVEAXZWJIOKB-JYRVWZFOSA-N