General Information of the Compound
| Compound ID |
CP0442879
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| Compound Name |
N-[1-(hydroxymethyl)cyclohexyl]-4-phenyl-1H-benzimidazole-2-carboxamide
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| Structure |
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| Formula |
C21H23N3O2
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| Molecular Weight |
349.434
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| Canonical SMILES |
OCC1(CCCCC1)NC(=O)c1nc2c(cccc2[nH]1)-c1ccccc1
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| InChI |
InChI=1S/C21H23N3O2/c25-14-21(12-5-2-6-13-21)24-20(26)19-22-17-11-7-10-16(18(17)23-19)15-8-3-1-4-9-15/h1,3-4,7-11,25H,2,5-6,12-14H2,(H,22,23)(H,24,26)
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| InChIKey |
SKJFRPOEZSVSCJ-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: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2