General Information of the Compound
| Compound ID |
CP0469635
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| Compound Name |
2-(3-(1-(4,4-dimethylcyclohexyl)piperidin-4-yl)-2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-N-methylacetamide
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| Structure |
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| Formula |
C23H34N4O2
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| Molecular Weight |
398.551
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| Canonical SMILES |
CNC(=O)Cn1c2ccccc2n(C2CCN(CC2)C2CCC(C)(C)CC2)c1=O
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| InChI |
InChI=1S/C23H34N4O2/c1-23(2)12-8-17(9-13-23)25-14-10-18(11-15-25)27-20-7-5-4-6-19(20)26(22(27)29)16-21(28)24-3/h4-7,17-18H,8-16H2,1-3H3,(H,24,28)
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| InChIKey |
SOBAXTKZXCMWII-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