General Information of the Compound
| Compound ID |
CP0573600
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| Compound Name |
2-N-(3-cyano-4-fluorophenyl)-1-methyl-4-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyrrole-2,4-dicarboxamide
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| Structure |
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| Formula |
C17H14F4N4O2
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| Molecular Weight |
382.317
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| Canonical SMILES |
C[C@@H](NC(=O)c1cc(C(=O)Nc2ccc(F)c(c2)C#N)n(C)c1)C(F)(F)F
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| InChI |
InChI=1S/C17H14F4N4O2/c1-9(17(19,20)21)23-15(26)11-6-14(25(2)8-11)16(27)24-12-3-4-13(18)10(5-12)7-22/h3-6,8-9H,1-2H3,(H,23,26)(H,24,27)/t9-/m1/s1
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| InChIKey |
NAFXJDLVILIGDU-SECBINFHSA-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