General Information of the Compound
| Compound ID |
CP0208002
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| Compound Name |
(6S,7S)-6,7,8,8-Tetramethyl-4-trifluoromethyl-6,7,8,9-tetrahydro-1H-pyrido[3,2-g]quinolin-2-one
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| Structure |
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| Formula |
C17H19F3N2O
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| Molecular Weight |
324.346
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| Canonical SMILES |
C[C@H]1[C@H](C)C(C)(C)Nc2cc3[nH]c(=O)cc(c3cc12)C(F)(F)F
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| InChI |
InChI=1S/C17H19F3N2O/c1-8-9(2)16(3,4)22-14-7-13-11(5-10(8)14)12(17(18,19)20)6-15(23)21-13/h5-9,22H,1-4H3,(H,21,23)/t8-,9-/m0/s1
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| InChIKey |
PDXCFTVMFXAKMC-IUCAKERBSA-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: PT01172, Progesterone receptor