General Information of the Compound
| Compound ID |
CP0563036
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| Compound Name |
2-[3-[1-(2,5-dimethoxyphenyl)ethyl]-4-oxoquinazolin-6-yl]benzenesulfonamide
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| Structure |
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| Formula |
C24H23N3O5S
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| Molecular Weight |
465.531
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| Canonical SMILES |
COc1ccc(OC)c(c1)C(C)n1cnc2ccc(cc2c1=O)-c1ccccc1S(N)(=O)=O
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| InChI |
InChI=1S/C24H23N3O5S/c1-15(19-13-17(31-2)9-11-22(19)32-3)27-14-26-21-10-8-16(12-20(21)24(27)28)18-6-4-5-7-23(18)33(25,29)30/h4-15H,1-3H3,(H2,25,29,30)
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| InChIKey |
PHUPQQXOHADNPR-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