General Information of the Compound
| Compound ID |
CP0433309
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| Compound Name |
1-benzhydryl-4-(3-methylthiophen-2-yl)piperidin-4-ol
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| Structure |
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| Formula |
C23H25NOS
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| Molecular Weight |
363.526
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| Canonical SMILES |
Cc1ccsc1C1(O)CCN(CC1)C(c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C23H25NOS/c1-18-12-17-26-22(18)23(25)13-15-24(16-14-23)21(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-12,17,21,25H,13-16H2,1H3
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| InChIKey |
GGAITJRZAAULQE-UHFFFAOYSA-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: PT00983, Kappa-type opioid receptor
Protein ID: PT01515, Mu-type opioid receptor
Protein ID: PT01360, Nociceptin receptor