General Information of the Compound
| Compound ID |
CP0548150
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| Compound Name |
1-(4-amino-5-methoxyquinazolin-7-yl)-3,6,6-trimethyl-5,7-dihydroindol-4-one
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| Structure |
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| Formula |
C20H22N4O2
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| Molecular Weight |
350.422
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| Canonical SMILES |
COc1cc(cc2ncnc(N)c12)-n1cc(C)c2c1CC(C)(C)CC2=O
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| InChI |
InChI=1S/C20H22N4O2/c1-11-9-24(14-7-20(2,3)8-15(25)17(11)14)12-5-13-18(16(6-12)26-4)19(21)23-10-22-13/h5-6,9-10H,7-8H2,1-4H3,(H2,21,22,23)
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| InChIKey |
UPBXXAQSXMZZBY-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