General Information of the Compound
| Compound ID |
CP0309154
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| Compound Name |
2-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]cyclohexa-2,5-diene-1,4-dione
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| Structure |
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| Formula |
C18H17N3O5
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| Molecular Weight |
355.35
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| Canonical SMILES |
COCCOc1cc2ncnc(NC3=CC(=O)C=CC3=O)c2cc1OC
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| InChI |
InChI=1S/C18H17N3O5/c1-24-5-6-26-17-9-13-12(8-16(17)25-2)18(20-10-19-13)21-14-7-11(22)3-4-15(14)23/h3-4,7-10H,5-6H2,1-2H3,(H,19,20,21)
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| InChIKey |
QGHREIIGQGMVTP-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