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Name | CHEMBL3613167 |
---|---|
Molecular formula | C30H35ClN2O3 |
IUPAC name | (E)-N-[(1R,9R,11S,14S,19S)-15-(cyclopropylmethyl)-4-hydroxy-15-azapentacyclo[9.6.2.01,9.02,7.09,14]nonadeca-2(7),3,5,12-tetraen-19-yl]-3-(furan-3-yl)-N-methylprop-2-enamide;hydrochloride |
Molecular weight | 507.071 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | None |
Synonyms | N/A |
Inchi Key | CXRSLAPJNNXWPN-RWIWYQPJSA-N |
Inchi ID | InChI=1S/C30H34N2O3.ClH/c1-31(28(34)9-4-21-10-13-35-19-21)26-17-29-11-12-32(18-20-2-3-20)27-8-6-23(26)16-30(27,29)15-22-5-7-24(33)14-25(22)29;/h4-10,13-14,19-20,23,26-27,33H,2-3,11-12,15-18H2,1H3;1H/b9-4+;/t23-,26+,27+,29-,30-;/m1./s1 |
PubChem CID | 122188793 |
ChEMBL | CHEMBL3613167 |
IUPHAR | N/A |
BindingDB | 50118180 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
469454 | Delta-type opioid receptor | P32300 | Oprd1 | Mus musculus (Mouse) | 372 |
469452 | Kappa-type opioid receptor | P41145 | OPRK1 | Homo sapiens (Human) | 380 |
469453 | Kappa-type opioid receptor | P33534 | Oprk1 | Mus musculus (Mouse) | 380 |
469451 | Mu-type opioid receptor | P97266 | OPRM1 | Cavia porcellus (Guinea pig) | 98 |
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