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Ligand

NameCHEMBL2113149
Molecular formulaC35H42ClN5O2
IUPAC name(3R)-N-[(2R)-3-(4-chlorophenyl)-1-[4-[7-(dimethylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]piperazin-1-yl]-1-oxopropan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Molecular weight600.204
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP5.2
SynonymsSCHEMBL14591448
Inchi KeyBOSMDIPMRDHNDU-HMDBZMABSA-N
Inchi IDInChI=1S/C35H42ClN5O2/c1-39(2)29-15-12-25-8-5-9-33(30(25)22-29)40-16-18-41(19-17-40)35(43)32(20-24-10-13-28(36)14-11-24)38-34(42)31-21-26-6-3-4-7-27(26)23-37-31/h3-11,13-14,29,31-32,37H,12,15-23H2,1-2H3,(H,38,42)/t29?,31-,32-/m1/s1
PubChem CID58777892
ChEMBLCHEMBL2113149
IUPHARN/A
BindingDBN/A
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
29092Melanocortin receptor 3P41968MC3RHomo sapiens (Human)323
29095Melanocortin receptor 4P32245MC4RHomo sapiens (Human)332
29094Melanocortin receptor 5P33032MC5RHomo sapiens (Human)325
29093Melanocyte-stimulating hormone receptorQ01726MC1RHomo sapiens (Human)317

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