General Information of the Compound
| Compound ID |
CP0506480
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| Compound Name |
4-(7-Fluoro-4-oxo-4H-quinazolin-3-yl)-butyric acid ethyl ester
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| Structure |
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| Formula |
C14H15FN2O3
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| Molecular Weight |
278.283
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| Canonical SMILES |
CCOC(=O)CCCn1cnc2cc(F)ccc2c1=O
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| InChI |
InChI=1S/C14H15FN2O3/c1-2-20-13(18)4-3-7-17-9-16-12-8-10(15)5-6-11(12)14(17)19/h5-6,8-9H,2-4,7H2,1H3
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| InChIKey |
ANCORYVGFATUPF-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