General Information of the Compound
| Compound ID |
CP0433779
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| Compound Name |
4-[(5-hydroxy-2-methylphenyl)amino]-N-(propan-2-yl)quinoline-6-carboxamide
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| Structure |
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| Formula |
C20H21N3O2
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| Molecular Weight |
335.407
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| Canonical SMILES |
CC(C)NC(=O)c1ccc2nccc(Nc3cc(O)ccc3C)c2c1
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| InChI |
InChI=1S/C20H21N3O2/c1-12(2)22-20(25)14-5-7-17-16(10-14)18(8-9-21-17)23-19-11-15(24)6-4-13(19)3/h4-12,24H,1-3H3,(H,21,23)(H,22,25)
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| InChIKey |
BGENYXBKHAIHOL-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