General Information of the Compound
| Compound ID |
CP0141388
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| Compound Name |
N-methyl-N-[2-[methyl-(4-oxochromene-3-carbonyl)amino]ethyl]-1-(3-nitrophenyl)sulfonylindole-3-carboxamide
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| Structure |
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| Formula |
C29H24N4O8S
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| Molecular Weight |
588.598
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| Canonical SMILES |
CN(CCN(C)C(=O)c1coc2ccccc2c1=O)C(=O)c1cn(c2ccccc12)S(=O)(=O)c1cccc(c1)[N+]([O-])=O
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| InChI |
InChI=1S/C29H24N4O8S/c1-30(14-15-31(2)29(36)24-18-41-26-13-6-4-11-22(26)27(24)34)28(35)23-17-32(25-12-5-3-10-21(23)25)42(39,40)20-9-7-8-19(16-20)33(37)38/h3-13,16-18H,14-15H2,1-2H3
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| InChIKey |
CASABOSNGORYTE-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