General Information of the Compound
| Compound ID |
CP0448221
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| Compound Name |
2-Bromo-5,6-dichloro-1-(3-nitro-benzyl)-1H-benzoimidazole
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| Structure |
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| Formula |
C14H8BrCl2N3O2
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| Molecular Weight |
401.047
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| Canonical SMILES |
[O-][N+](=O)c1cccc(Cn2c(Br)nc3cc(Cl)c(Cl)cc23)c1
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| InChI |
InChI=1S/C14H8BrCl2N3O2/c15-14-18-12-5-10(16)11(17)6-13(12)19(14)7-8-2-1-3-9(4-8)20(21)22/h1-6H,7H2
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| InChIKey |
BBHZULZOWGSMKG-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