General Information of the Compound
| Compound ID |
CP0528546
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| Compound Name |
2-cyclobutyl-1-[8-(dimethylamino)-8-phenyl-2-azaspiro[4.5]decan-2-yl]ethanone
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| Structure |
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| Formula |
C23H34N2O
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| Molecular Weight |
354.538
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| Canonical SMILES |
CN(C)C1(CCC2(CCN(C2)C(=O)CC2CCC2)CC1)c1ccccc1
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| InChI |
InChI=1S/C23H34N2O/c1-24(2)23(20-9-4-3-5-10-20)13-11-22(12-14-23)15-16-25(18-22)21(26)17-19-7-6-8-19/h3-5,9-10,19H,6-8,11-18H2,1-2H3
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| InChIKey |
WKYUBQRUXDYGNX-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