General Information of the Compound
| Compound ID |
CP0549302
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| Compound Name |
1-[8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-2-yl]-2-cyclopropylethanone
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| Structure |
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| Formula |
C21H36N2O
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| Molecular Weight |
332.532
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| Canonical SMILES |
CN(C)C1(CCC2(CCN(C2)C(=O)CC2CC2)CC1)C1CCCC1
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| InChI |
InChI=1S/C21H36N2O/c1-22(2)21(18-5-3-4-6-18)11-9-20(10-12-21)13-14-23(16-20)19(24)15-17-7-8-17/h17-18H,3-16H2,1-2H3
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| InChIKey |
ADQGCAIBDMFHAQ-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