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Ligand

NameCHEMBL1270475
Molecular formulaC27H28N2O2
IUPAC name(1R,14S,15R)-25-(cyclopropylmethyl)-4,25-diazahexacyclo[13.7.3.01,14.03,12.05,10.017,22]pentacosa-3,5,7,9,11,17(22),18,20-octaene-14,20-diol
Molecular weight412.533
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.1
SynonymsBDBM50329100
Inchi KeyAJBWZNMIEOMJCC-ZONZVBGPSA-N
Inchi IDInChI=1S/C27H28N2O2/c30-21-8-7-18-12-25-27(31)14-20-11-19-3-1-2-4-23(19)28-24(20)15-26(27,22(18)13-21)9-10-29(25)16-17-5-6-17/h1-4,7-8,11,13,17,25,30-31H,5-6,9-10,12,14-16H2/t25-,26-,27-/m1/s1
PubChem CID52942140
ChEMBLCHEMBL1270475
IUPHARN/A
BindingDB50329100
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
6768Delta-type opioid receptorP32300Oprd1Mus musculus (Mouse)372
6766Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
6767Mu-type opioid receptorP42866Oprm1Mus musculus (Mouse)398

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