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Ligand

NameCHEMBL2147477
Molecular formulaC25H35FN6S
IUPAC name2-[3-[(4S)-1-[(2S)-1-(benzylamino)propan-2-yl]-3-[2-(3-fluorophenyl)ethyl]-2-sulfanylideneimidazolidin-4-yl]propyl]guanidine
Molecular weight470.655
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP2.9
Synonyms1055030-06-2
GTPL1315
BDBM50391543
TPI 1361-17
MCH1 receptor antagonist (obesity), Mixture Sciences
[ Show all ]
Inchi KeyDSJVYEAOYVHUJW-CVDCTZTESA-N
Inchi IDInChI=1S/C25H35FN6S/c1-19(16-29-17-21-7-3-2-4-8-21)32-18-23(11-6-13-30-24(27)28)31(25(32)33)14-12-20-9-5-10-22(26)15-20/h2-5,7-10,15,19,23,29H,6,11-14,16-18H2,1H3,(H4,27,28,30)/t19-,23-/m0/s1
PubChem CID11305934
ChEMBLCHEMBL2147477
IUPHAR1315
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
67657Melanin-concentrating hormone receptor 1P97639Mchr1Rattus norvegicus (Rat)353
553595Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422

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