General Information of the Compound
| Compound ID |
CP0386199
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| Compound Name |
6-[4-(4-fluorophenyl)-5-oxo-2H-furan-3-yl]-4H-1,4-benzoxazin-3-one
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| Structure |
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| Formula |
C18H12FNO4
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| Molecular Weight |
325.295
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| Canonical SMILES |
Fc1ccc(cc1)C1=C(COC1=O)c1ccc2OCC(=O)Nc2c1
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| InChI |
InChI=1S/C18H12FNO4/c19-12-4-1-10(2-5-12)17-13(8-24-18(17)22)11-3-6-15-14(7-11)20-16(21)9-23-15/h1-7H,8-9H2,(H,20,21)
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| InChIKey |
GUKNLDXVUBZZLL-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
Protein ID: PT00894, Androgen receptor
Protein ID: PT00967, Glucocorticoid receptor
Protein ID: PT01154, Mineralocorticoid receptor
Protein ID: PT01172, Progesterone receptor