General Information of the Compound
| Compound ID |
CP0525924
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| Compound Name |
4-(6-(trifluoromethyl)-2-(4-(3-(trifluoromethyl)pyridin-2-yl)-piperazin-1-yl)-1H-benzo[d]imidazol-4-yl)benzenamine
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| Structure |
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| Formula |
C24H20F6N6
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| Molecular Weight |
506.454
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| Canonical SMILES |
Nc1ccc(cc1)-c1cc(cc2[nH]c(nc12)N1CCN(CC1)c1ncccc1C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C24H20F6N6/c25-23(26,27)15-12-17(14-3-5-16(31)6-4-14)20-19(13-15)33-22(34-20)36-10-8-35(9-11-36)21-18(24(28,29)30)2-1-7-32-21/h1-7,12-13H,8-11,31H2,(H,33,34)
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| InChIKey |
JNTGBUJJXLSOMJ-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