General Information of the Compound
| Compound ID |
CP0496725
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| Compound Name |
2-methylpropyl N-[(3-methoxy-2-phenylquinoline-4-carbonyl)amino]-N-phenylcarbamate
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| Structure |
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| Formula |
C28H27N3O4
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| Molecular Weight |
469.541
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| Canonical SMILES |
COc1c(nc2ccccc2c1C(=O)NN(C(=O)OCC(C)C)c1ccccc1)-c1ccccc1
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| InChI |
InChI=1S/C28H27N3O4/c1-19(2)18-35-28(33)31(21-14-8-5-9-15-21)30-27(32)24-22-16-10-11-17-23(22)29-25(26(24)34-3)20-12-6-4-7-13-20/h4-17,19H,18H2,1-3H3,(H,30,32)
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| InChIKey |
ZFWLGOHBPDLTBB-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