General Information of the Compound
| Compound ID |
CP0415776
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| Compound Name |
N-[(3-chlorophenyl)methyl]-1-ethyl-4-phenylbenzimidazole-2-carboxamide
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| Structure |
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| Formula |
C23H20ClN3O
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| Molecular Weight |
389.886
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| Canonical SMILES |
CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCc1cccc(Cl)c1
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| InChI |
InChI=1S/C23H20ClN3O/c1-2-27-20-13-7-12-19(17-9-4-3-5-10-17)21(20)26-22(27)23(28)25-15-16-8-6-11-18(24)14-16/h3-14H,2,15H2,1H3,(H,25,28)
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| InChIKey |
XZXZGCFBSYLNCP-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