General Information of the Compound
| Compound ID |
CP0504818
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| Compound Name |
1-Isopropyl-4-(4-cyclopropyl-phenyl)-6-methoxy-1H-quinazolin-2-one
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| Structure |
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| Formula |
C21H22N2O2
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| Molecular Weight |
334.419
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| Canonical SMILES |
COc1ccc2n(C(C)C)c(=O)nc(-c3ccc(cc3)C3CC3)c2c1
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| InChI |
InChI=1S/C21H22N2O2/c1-13(2)23-19-11-10-17(25-3)12-18(19)20(22-21(23)24)16-8-6-15(7-9-16)14-4-5-14/h6-14H,4-5H2,1-3H3
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| InChIKey |
COGOPHJRGGXFEO-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