General Information of the Compound
| Compound ID |
CP0384126
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| Compound Name |
5-(4-Methanesulfonyl-phenyl)-2-methyl-4-phenyl-2H-pyridazin-3-one
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| Structure |
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| Formula |
C18H16N2O3S
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| Molecular Weight |
340.404
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| Canonical SMILES |
Cn1ncc(-c2ccc(cc2)S(C)(=O)=O)c(-c2ccccc2)c1=O
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| InChI |
InChI=1S/C18H16N2O3S/c1-20-18(21)17(14-6-4-3-5-7-14)16(12-19-20)13-8-10-15(11-9-13)24(2,22)23/h3-12H,1-2H3
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| InChIKey |
SOXCONLVKYENQQ-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