General Information of the Compound
| Compound ID |
CP0888570
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| Compound Name |
4-((5,6-dichloro-3-ethyl-2-(4-(trifluoromethoxy)phenylimino)-2,3-dihydro-1H-benzo[d]imidazol-1-yl)methyl)-N-(1H-tetrazol-5-yl)benzamide
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| Formula |
C25H19Cl2F3N8O2
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| Molecular Weight |
591.381
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| Canonical SMILES |
CCn1/c(=N/c2ccc(OC(F)(F)F)cc2)n(Cc2ccc(C(=O)Nc3nnn[nH]3)cc2)c2cc(Cl)c(Cl)cc21
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| InChI |
InChI=1S/C25H19Cl2F3N8O2/c1-2-37-20-11-18(26)19(27)12-21(20)38(24(37)31-16-7-9-17(10-8-16)40-25(28,29)30)13-14-3-5-15(6-4-14)22(39)32-23-33-35-36-34-23/h3-12H,2,13H2,1H3,(H2,32,33,34,35,36,39)/b31-24-
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| InChIKey |
ASYWMKSHJIMXME-QLTSDVKISA-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