General Information of the Compound
| Compound ID |
CP0501132
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| Compound Name |
methyl N-(2-fluorophenyl)-N-[(3-methoxy-2-phenylquinoline-4-carbonyl)amino]carbamate
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| Structure |
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| Formula |
C25H20FN3O4
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| Molecular Weight |
445.45
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| Canonical SMILES |
COC(=O)N(NC(=O)c1c(OC)c(nc2ccccc12)-c1ccccc1)c1ccccc1F
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| InChI |
InChI=1S/C25H20FN3O4/c1-32-23-21(24(30)28-29(25(31)33-2)20-15-9-7-13-18(20)26)17-12-6-8-14-19(17)27-22(23)16-10-4-3-5-11-16/h3-15H,1-2H3,(H,28,30)
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| InChIKey |
MNQVHVGGWNTQLT-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