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Ligand

NameSCHEMBL3310286
Molecular formulaC23H23NO3
IUPAC name2-[[2-(cyclopenten-1-yl)-3-methylbenzoyl]amino]-1,3-dihydroindene-2-carboxylic acid
Molecular weight361.441
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP4.2
Synonyms2-(2-Cyclopent-1-enyl-3-methyl-benzoylamino)-indan-2-carboxylic acid
JMXZJWLQQXRYCF-UHFFFAOYSA-N
CHEMBL3715092
Inchi KeyJMXZJWLQQXRYCF-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H23NO3/c1-15-7-6-12-19(20(15)16-8-2-3-9-16)21(25)24-23(22(26)27)13-17-10-4-5-11-18(17)14-23/h4-8,10-12H,2-3,9,13-14H2,1H3,(H,24,25)(H,26,27)
PubChem CID25159486
ChEMBLCHEMBL3715092
IUPHARN/A
BindingDBN/A
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
525938C-X-C chemokine receptor type 5P32302CXCR5Homo sapiens (Human)372

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