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Ligand

NameCHEMBL383432
Molecular formulaC28H33ClF4N4O2
IUPAC name3-(3-chloro-4-fluorophenyl)-1-[3-(4-methylpiperazin-1-yl)propyl]-1-[(1S,2R,5S)-5-[4-(trifluoromethoxy)phenyl]-2-bicyclo[3.1.0]hexanyl]urea
Molecular weight569.042
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP5.9
SynonymsBDBM50184946
N''-(3-chloro-4-fluorophenyl)-N-[3-(4-methyl-1-piperazinyl)-propyl]-N-[trans-5-[4-(trifluoromethoxy)phenyl]bicyclo[3.1.0]-hex-2-yl]urea
SCHEMBL14265857
Inchi KeyCUAOLPFNRIMUNG-AVPJRLCVSA-N
Inchi IDInChI=1S/C28H33ClF4N4O2/c1-35-13-15-36(16-14-35)11-2-12-37(26(38)34-20-5-8-24(30)23(29)17-20)25-9-10-27(18-22(25)27)19-3-6-21(7-4-19)39-28(31,32)33/h3-8,17,22,25H,2,9-16,18H2,1H3,(H,34,38)/t22-,25-,27-/m1/s1
PubChem CID10312052
ChEMBLCHEMBL383432
IUPHARN/A
BindingDB50184946
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
50595Melanin-concentrating hormone receptor 1Q8JZL2Mchr1Mus musculus (Mouse)353
50596Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422

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