General Information of the Compound
| Compound ID |
CP0427471
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| Compound Name |
N-[4-[(2-chlorophenyl)-methylsulfamoyl]phenyl]pyrimidine-4-carboxamide
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| Structure |
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| Formula |
C18H15ClN4O3S
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| Molecular Weight |
402.863
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| Canonical SMILES |
CN(c1ccccc1Cl)S(=O)(=O)c1ccc(NC(=O)c2ccncn2)cc1
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| InChI |
InChI=1S/C18H15ClN4O3S/c1-23(17-5-3-2-4-15(17)19)27(25,26)14-8-6-13(7-9-14)22-18(24)16-10-11-20-12-21-16/h2-12H,1H3,(H,22,24)
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| InChIKey |
KUNXGLVWEOQNCV-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