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Ligand

NameSCHEMBL1651439
Molecular formulaC28H33ClN2O5
IUPAC name(E)-N-[(4R,4aS,7R,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl]-3-(furan-3-yl)-N-methylprop-2-enamide;hydron;chloride
Molecular weight513.031
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogPNone
SynonymsN/A
Inchi KeyDJSFYNINGIMKAG-FQJQBBMWSA-N
Inchi IDInChI=1S/C28H32N2O5.ClH/c1-29(23(32)7-4-18-9-13-34-16-18)20-8-10-28(33)22-14-19-5-6-21(31)25-24(19)27(28,26(20)35-25)11-12-30(22)15-17-2-3-17;/h4-7,9,13,16-17,20,22,26,31,33H,2-3,8,10-12,14-15H2,1H3;1H/b7-4+;/t20-,22-,26+,27+,28-;/m1./s1
PubChem CID57517678
ChEMBLCHEMBL490665
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
61779Delta-type opioid receptorP32300Oprd1Mus musculus (Mouse)372
61777Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
61780Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
61781Kappa-type opioid receptorP33534Oprk1Mus musculus (Mouse)380
61776Mu-type opioid receptorP42866Oprm1Mus musculus (Mouse)398
61778Mu-type opioid receptorP97266OPRM1Cavia porcellus (Guinea pig)98

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