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Ligand

NameCHEMBL35715
Molecular formulaC24H38O6
IUPAC name7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3R)-3-hydroxy-5-(3-methoxyphenyl)pentyl]cyclopentyl]heptanoic acid
Molecular weight422.562
Hydrogen bond acceptor6
Hydrogen bond donor4
XlogP3.9
Synonyms7-{(1R,2R,3R,5S)-3,5-Dihydroxy-2-[(R)-3-hydroxy-5-(3-methoxy-phenyl)-pentyl]-cyclopentyl}-heptanoic acid
BDBM50090138
7-[(1R)-2beta-[(3R)-3-Hydroxy-5-(3-methoxyphenyl)pentyl]-3alpha,5alpha-dihydroxycyclopentane-1alpha-yl]heptanoic acid
Inchi KeyDAQYIUROFOIFAX-PBZQEHOFSA-N
Inchi IDInChI=1S/C24H38O6/c1-30-19-8-6-7-17(15-19)11-12-18(25)13-14-21-20(22(26)16-23(21)27)9-4-2-3-5-10-24(28)29/h6-8,15,18,20-23,25-27H,2-5,9-14,16H2,1H3,(H,28,29)/t18-,20+,21+,22-,23+/m0/s1
PubChem CID44285252
ChEMBLCHEMBL35715
IUPHARN/A
BindingDB50090138
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
55257Prostaglandin E2 receptor EP1 subtypeP34995PTGER1Homo sapiens (Human)402
55258Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390
55256Prostaglandin F2-alpha receptorP43088PTGFRHomo sapiens (Human)359
55259Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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