General Information of the Compound
| Compound ID |
CP0307428
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| Compound Name |
4-(3,4-Dimethoxy-phenylsulfanyl)-6,7-dimethoxy-quinazoline
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| Structure |
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| Formula |
C18H18N2O4S
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| Molecular Weight |
358.419
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| Canonical SMILES |
COc1ccc(Sc2ncnc3cc(OC)c(OC)cc23)cc1OC
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| InChI |
InChI=1S/C18H18N2O4S/c1-21-14-6-5-11(7-15(14)22-2)25-18-12-8-16(23-3)17(24-4)9-13(12)19-10-20-18/h5-10H,1-4H3
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| InChIKey |
SZTVCYCQIWQZCI-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