General Information of the Compound
| Compound ID |
CP0563034
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| Compound Name |
3-[2-(3,5-dimethoxyphenyl)ethyl]-6-piperidin-1-ylsulfonylquinazolin-4-one
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| Structure |
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| Formula |
C23H27N3O5S
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| Molecular Weight |
457.552
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| Canonical SMILES |
COc1cc(CCn2cnc3ccc(cc3c2=O)S(=O)(=O)N2CCCCC2)cc(OC)c1
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| InChI |
InChI=1S/C23H27N3O5S/c1-30-18-12-17(13-19(14-18)31-2)8-11-25-16-24-22-7-6-20(15-21(22)23(25)27)32(28,29)26-9-4-3-5-10-26/h6-7,12-16H,3-5,8-11H2,1-2H3
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| InChIKey |
FKHCMHKLPKGKCR-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