General Information of the Compound
| Compound ID |
CP0426931
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| Compound Name |
N-(1H-benzimidazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide
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| Structure |
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| Formula |
C18H18ClN3O
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| Molecular Weight |
327.815
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| Canonical SMILES |
CC(C)C(C(=O)Nc1nc2ccccc2[nH]1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C18H18ClN3O/c1-11(2)16(12-7-9-13(19)10-8-12)17(23)22-18-20-14-5-3-4-6-15(14)21-18/h3-11,16H,1-2H3,(H2,20,21,22,23)
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| InChIKey |
YGXFVCBCJIVVGV-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