General Information of the Compound
| Compound ID |
CP0888569
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| Compound Name |
4-((3-methyl-6-propoxy-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 |
C27H25F3N8O3
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| Molecular Weight |
566.544
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| Canonical SMILES |
CCCOc1ccc2c(c1)n(Cc1ccc(C(=O)Nc3nnn[nH]3)cc1)/c(=N\c1ccc(OC(F)(F)F)cc1)n2C
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| InChI |
InChI=1S/C27H25F3N8O3/c1-3-14-40-21-12-13-22-23(15-21)38(16-17-4-6-18(7-5-17)24(39)32-25-33-35-36-34-25)26(37(22)2)31-19-8-10-20(11-9-19)41-27(28,29)30/h4-13,15H,3,14,16H2,1-2H3,(H2,32,33,34,35,36,39)/b31-26-
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| InChIKey |
YAFVCEBVJOZSCV-ZXPTYKNPSA-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