General Information of the Compound
| Compound ID |
CP0378599
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| Compound Name |
2-[5-(3-chloro-4-fluorophenyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indol-3-yl]acetamide
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| Structure |
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| Formula |
C24H17ClF4N2O
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| Molecular Weight |
460.858
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| Canonical SMILES |
NC(=O)Cc1cn(Cc2cccc(c2)C(F)(F)F)c2ccc(cc12)-c1ccc(F)c(Cl)c1
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| InChI |
InChI=1S/C24H17ClF4N2O/c25-20-10-16(4-6-21(20)26)15-5-7-22-19(9-15)17(11-23(30)32)13-31(22)12-14-2-1-3-18(8-14)24(27,28)29/h1-10,13H,11-12H2,(H2,30,32)
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| InChIKey |
PKABMUJNSBAFFN-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