General Information of the Compound
| Compound ID |
CP0524476
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| Compound Name |
1-[1-(2-Cyclohexyl-2-hydroxy-ethyl)-piperidin-4-yl]-1,3-dihydro-benzoimidazol-2-one
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| Structure |
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| Formula |
C20H29N3O2
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| Molecular Weight |
343.471
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| Canonical SMILES |
OC(CN1CCC(CC1)n1c2ccccc2[nH]c1=O)C1CCCCC1
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| InChI |
InChI=1S/C20H29N3O2/c24-19(15-6-2-1-3-7-15)14-22-12-10-16(11-13-22)23-18-9-5-4-8-17(18)21-20(23)25/h4-5,8-9,15-16,19,24H,1-3,6-7,10-14H2,(H,21,25)
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| InChIKey |
LAUXQQGPTMHJHY-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