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Ligand

NameCHEMBL1173643
Molecular formulaC27H22FN5O3
IUPAC nameN-[3-cyano-6-(4-fluoro-2-hydroxyphenyl)-4-(3-piperazin-1-ylphenyl)pyridin-2-yl]furan-2-carboxamide
Molecular weight483.503
Hydrogen bond acceptor8
Hydrogen bond donor3
XlogP4.2
SynonymsN-[3-Cyano-6-(4-fluoro-2-hydroxyphenyl)-4-(3-piperazin-1-ylphenyl)pyridin-2-yl]furan-2-carboxamide
N-[3-Cyano-6-(4-fluoro-2-hydroxyphenyl)-4-(3-piperazinophenyl)-2-pyridyl]-2-furancarboxamide
SCHEMBL13802047
BDBM50322299
Inchi KeyUCWLBOAGWWOUDD-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H22FN5O3/c28-18-6-7-20(24(34)14-18)23-15-21(17-3-1-4-19(13-17)33-10-8-30-9-11-33)22(16-29)26(31-23)32-27(35)25-5-2-12-36-25/h1-7,12-15,30,34H,8-11H2,(H,31,32,35)
PubChem CID135401501
ChEMBLCHEMBL1173643
IUPHARN/A
BindingDB50322299
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
567737KiSS-1 receptorQ969F8KISS1RHomo sapiens (Human)398
567738KiSS-1 receptorQ924U1Kiss1rRattus norvegicus (Rat)396

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