General Information of the Compound
| Compound ID |
CP0390056
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| Compound Name |
(S)-(1,2,3,5,6,8a-hexahydroindolizin-8-yl)(2-hydroxy-6-methylphenyl)methanone
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| Structure |
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| Formula |
C16H19NO2
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| Molecular Weight |
257.333
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| Canonical SMILES |
Cc1cccc(O)c1C(=O)C1=CCCN2CCC[C@@H]12
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| InChI |
InChI=1S/C16H19NO2/c1-11-5-2-8-14(18)15(11)16(19)12-6-3-9-17-10-4-7-13(12)17/h2,5-6,8,13,18H,3-4,7,9-10H2,1H3/t13-/m0/s1
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| InChIKey |
KNSLYJICIDVPEX-ZDUSSCGKSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01200, Delta-type opioid receptor
Protein ID: PT01460, Kappa-type opioid receptor
Protein ID: PT01515, Mu-type opioid receptor