General Information of the Compound
| Compound ID |
CP0454299
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| Compound Name |
2-(4-chloro-2-imino-3-methylbenzimidazol-1-yl)-1-(4-chlorophenyl)ethanone
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| Structure |
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| Formula |
C16H13Cl2N3O
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| Molecular Weight |
334.206
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| Canonical SMILES |
Cn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
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| InChI |
InChI=1S/C16H13Cl2N3O/c1-20-15-12(18)3-2-4-13(15)21(16(20)19)9-14(22)10-5-7-11(17)8-6-10/h2-8,19H,9H2,1H3
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| InChIKey |
PLMCHRDOZVTOMW-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