General Information of the Compound
| Compound ID |
CP0954676
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| Compound Name |
4-chloro-1-ethyl-2-(hydroxydiphenylmethyl)-1H-benzo[d]imidazole-6-carboxylic acid
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| Structure |
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| Formula |
C23H19ClN2O3
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| Molecular Weight |
406.869
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| Canonical SMILES |
CCn1c(C(O)(c2ccccc2)c2ccccc2)nc2c(Cl)cc(C(=O)O)cc21
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| InChI |
InChI=1S/C23H19ClN2O3/c1-2-26-19-14-15(21(27)28)13-18(24)20(19)25-22(26)23(29,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-14,29H,2H2,1H3,(H,27,28)
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| InChIKey |
CYPANNGLEVFHSU-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