General Information of the Compound
| Compound ID |
CP0563038
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| Compound Name |
2-[3-[2-(3,5-dimethoxyphenyl)ethyl]-4-oxoquinazolin-6-yl]-N,N-dimethylbenzenesulfonamide
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| Structure |
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| Formula |
C26H27N3O5S
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| Molecular Weight |
493.585
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| Canonical SMILES |
COc1cc(CCn2cnc3ccc(cc3c2=O)-c2ccccc2S(=O)(=O)N(C)C)cc(OC)c1
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| InChI |
InChI=1S/C26H27N3O5S/c1-28(2)35(31,32)25-8-6-5-7-22(25)19-9-10-24-23(15-19)26(30)29(17-27-24)12-11-18-13-20(33-3)16-21(14-18)34-4/h5-10,13-17H,11-12H2,1-4H3
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| InChIKey |
UNOKTSPSRMFMKO-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