General Information of the Compound
| Compound ID |
CP0557090
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| Compound Name |
1-[6-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]pyrimidin-4-yl]-N-(2-methoxyethyl)-2,3-dihydroindole-4-carboxamide
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| Formula |
C24H22F4N4O2
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| Molecular Weight |
474.458
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| Canonical SMILES |
COCCNC(=O)c1cccc2N(CCc12)c1cc(Cc2cc(F)cc(c2)C(F)(F)F)ncn1
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| InChI |
InChI=1S/C24H22F4N4O2/c1-34-8-6-29-23(33)20-3-2-4-21-19(20)5-7-32(21)22-13-18(30-14-31-22)11-15-9-16(24(26,27)28)12-17(25)10-15/h2-4,9-10,12-14H,5-8,11H2,1H3,(H,29,33)
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| InChIKey |
NYBWCJONWGAWGX-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