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Ligand

NameCHEMBL188173
Molecular formulaC27H40N4O2
IUPAC nameN-[1-(cyclohexylamino)-1-oxopropan-2-yl]-N-[3-(diethylamino)propyl]-5-phenyl-1H-pyrrole-2-carboxamide
Molecular weight452.643
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP4.9
SynonymsBDBM50151165
5-Phenyl-1H-pyrrole-2-carboxylic acid (1-cyclohexylcarbamoyl-ethyl)-(3-diethylamino-propyl)-amide
Inchi KeyAOJOWVZKOSBKPY-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H40N4O2/c1-4-30(5-2)19-12-20-31(21(3)26(32)28-23-15-10-7-11-16-23)27(33)25-18-17-24(29-25)22-13-8-6-9-14-22/h6,8-9,13-14,17-18,21,23,29H,4-5,7,10-12,15-16,19-20H2,1-3H3,(H,28,32)
PubChem CID44396306
ChEMBLCHEMBL188173
IUPHARN/A
BindingDB50151165
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
10294Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366

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