General Information of the Compound
| Compound ID |
CP0395481
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| Compound Name |
N-[(E)-[6-methyl-2-(4-methylphenoxy)quinolin-3-yl]methylideneamino]-2-(2-methyl-5-nitroimidazol-1-yl)acetamide
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| Structure |
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| Formula |
C24H22N6O4
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| Molecular Weight |
458.478
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| Canonical SMILES |
Cc1ncc(n1CC(=O)N\N=C\c1cc2cc(C)ccc2nc1Oc1ccc(C)cc1)[N+]([O-])=O
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| InChI |
InChI=1S/C24H22N6O4/c1-15-4-7-20(8-5-15)34-24-19(11-18-10-16(2)6-9-21(18)27-24)12-26-28-22(31)14-29-17(3)25-13-23(29)30(32)33/h4-13H,14H2,1-3H3,(H,28,31)/b26-12+
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| InChIKey |
ROYUJUFXDGQEMG-RPPGKUMJSA-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