General Information of the Compound
| Compound ID |
CP0559082
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| Compound Name |
1-[4-(3,4-dihydropyrazol-2-yl)phenyl]sulfonyl-4-methyl-2,3-dihydroquinoxaline
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| Structure |
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| Formula |
C18H20N4O2S
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| Molecular Weight |
356.451
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| Canonical SMILES |
CN1CCN(c2ccccc12)S(=O)(=O)c1ccc(cc1)N1CCC=N1
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| InChI |
InChI=1S/C18H20N4O2S/c1-20-13-14-22(18-6-3-2-5-17(18)20)25(23,24)16-9-7-15(8-10-16)21-12-4-11-19-21/h2-3,5-11H,4,12-14H2,1H3
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| InChIKey |
GJESZOSTILOBLJ-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