General Information of the Compound
| Compound ID |
CP0969729
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| Compound Name |
N2-(2,4-dichloro-6-methylphenyl)-1-methyl-N7,N7-dipropyl-1H-benzo[d]imidazole-2,7-diamine 2,2,2-trifluoroacetate
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| Structure |
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| Formula |
C23H27Cl2F3N4O2
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| Molecular Weight |
519.395
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| Canonical SMILES |
CCCN(CCC)c1cccc2nc(Nc3c(C)cc(Cl)cc3Cl)n(C)c12.O=C(O)C(F)(F)F
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| InChI |
InChI=1S/C21H26Cl2N4.C2HF3O2/c1-5-10-27(11-6-2)18-9-7-8-17-20(18)26(4)21(24-17)25-19-14(3)12-15(22)13-16(19)23;3-2(4,5)1(6)7/h7-9,12-13H,5-6,10-11H2,1-4H3,(H,24,25);(H,6,7)
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| InChIKey |
WVZODIBZRYITBY-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