General Information of the Compound
| Compound ID |
CP0508900
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| Compound Name |
1-[5-cyano-2-(2-methylanilino)phenyl]sulfonyl-3-propan-2-ylurea
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| Structure |
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| Formula |
C18H20N4O3S
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| Molecular Weight |
372.45
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| Canonical SMILES |
CC(C)NC(=O)NS(=O)(=O)c1cc(ccc1Nc1ccccc1C)C#N
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| InChI |
InChI=1S/C18H20N4O3S/c1-12(2)20-18(23)22-26(24,25)17-10-14(11-19)8-9-16(17)21-15-7-5-4-6-13(15)3/h4-10,12,21H,1-3H3,(H2,20,22,23)
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| InChIKey |
UDULVWKAFXLLKY-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