General Information of the Compound
| Compound ID |
CP0848412
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| Compound Name |
3-{(2,3-Dihydro-1'H-spiro[indene-1,4'-piperidin]-1'-yl)methyl}-1,2,3,4-tetrahydroisoquinolin-6-ol
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| Structure |
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| Formula |
C23H28N2O
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| Molecular Weight |
348.49
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| Canonical SMILES |
Oc1ccc2c(c1)CC(CN1CCC3(CCc4ccccc43)CC1)NC2
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| InChI |
InChI=1S/C23H28N2O/c26-21-6-5-18-15-24-20(13-19(18)14-21)16-25-11-9-23(10-12-25)8-7-17-3-1-2-4-22(17)23/h1-6,14,20,24,26H,7-13,15-16H2
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| InChIKey |
CPMLYZUSUXTRIP-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: PT01515, Mu-type opioid receptor
Protein ID: PT01360, Nociceptin receptor
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2