General Information of the Compound
| Compound ID |
CP0410429
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| Compound Name |
N-ethyl-N-(2-hydroxyethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-2-carboxamide
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| Structure |
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| Formula |
C19H18F3N3O2
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| Molecular Weight |
377.366
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| Canonical SMILES |
CCN(CCO)C(=O)c1cc2cccnc2n1-c1cccc(c1)C(F)(F)F
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| InChI |
InChI=1S/C19H18F3N3O2/c1-2-24(9-10-26)18(27)16-11-13-5-4-8-23-17(13)25(16)15-7-3-6-14(12-15)19(20,21)22/h3-8,11-12,26H,2,9-10H2,1H3
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| InChIKey |
OIVMROXJJVTNKU-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