General Information of the Compound
| Compound ID |
CP0446623
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| Compound Name |
3-(benzenesulfonyl)-N,9-dimethyl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-2-amine
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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 |
CNc1nn2c(C)c3CCCCc3nc2c1S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C18H20N4O2S/c1-12-14-10-6-7-11-15(14)20-18-16(17(19-2)21-22(12)18)25(23,24)13-8-4-3-5-9-13/h3-5,8-9H,6-7,10-11H2,1-2H3,(H,19,21)
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| InChIKey |
IFUHTYLFPBCCAD-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