General Information of the Compound
| Compound ID |
CP0440972
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| Compound Name |
1-(4-chlorophenyl)-2-(4-ethyl-2-imino-3-methylbenzimidazol-1-yl)ethanone
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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 |
CCc1cccc2n(CC(=O)c3ccc(Cl)cc3)c(=N)n(C)c12
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| InChI |
InChI=1S/C18H18ClN3O/c1-3-12-5-4-6-15-17(12)21(2)18(20)22(15)11-16(23)13-7-9-14(19)10-8-13/h4-10,20H,3,11H2,1-2H3
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| InChIKey |
CIOHYHPZIKPXGU-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