General Information of the Compound
| Compound ID |
CP0482005
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| Compound Name |
8-fluoro-2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4,5-dimethylphenanthridin-6-one
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| Structure |
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| Formula |
C18H12F7NO2
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| Molecular Weight |
407.285
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| Canonical SMILES |
Cc1cc(cc2c1n(C)c(=O)c1cc(F)ccc21)C(O)(C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C18H12F7NO2/c1-8-5-9(16(28,17(20,21)22)18(23,24)25)6-12-11-4-3-10(19)7-13(11)15(27)26(2)14(8)12/h3-7,28H,1-2H3
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| InChIKey |
XDFUKFMDLRMNOJ-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: PT03033, Nuclear receptor ROR-beta
Protein ID: PT01555, Oxysterols receptor LXR-alpha
Protein ID: PT01887, Oxysterols receptor LXR-beta
Protein ID: PT01172, Progesterone receptor