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Ligand

NameCHEMBL3215911
Molecular formulaC35H39Cl2N3O4
IUPAC name(1S,2R,6R,14R,15R,16R)-17-benzyl-5-(cyclopropylmethyl)-11,15-dihydroxy-N-phenyl-13-oxa-5,17-diazahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11-triene-16-carboxamide;dihydrochloride
Molecular weight636.614
Hydrogen bond acceptor6
Hydrogen bond donor5
XlogPNone
SynonymsN/A
Inchi KeyAKAMZPLWYUFWFA-TYLFJNAPSA-N
Inchi IDInChI=1S/C35H37N3O4.2ClH/c39-26-14-13-24-19-27-35-16-15-34(41,32-33(35,28(24)29(26)42-32)17-18-37(27)20-23-11-12-23)30(31(40)36-25-9-5-2-6-10-25)38(35)21-22-7-3-1-4-8-22;;/h1-10,13-14,23,27,30,32,39,41H,11-12,15-21H2,(H,36,40);2*1H/t27-,30+,32-,33+,34-,35-;;/m1../s1
PubChem CID90664479
ChEMBLCHEMBL3215911
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
7384Delta-type opioid receptorP32300Oprd1Mus musculus (Mouse)372
7383Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
7385Mu-type opioid receptorP42866Oprm1Mus musculus (Mouse)398

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