General Information of the Compound
| Compound ID |
CP0041438
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| Compound Name |
6'-trifluoromethylspiro[cyclohexane-1,2'-(1',2',3',4',8',9'-hexahydropyrido[3,2-g]quinoline)]-8'-one
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| Structure |
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| Formula |
C18H19F3N2O
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| Molecular Weight |
336.357
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| Canonical SMILES |
FC(F)(F)c1cc(=O)[nH]c2cc3NC4(CCCCC4)CCc3cc12
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| InChI |
InChI=1S/C18H19F3N2O/c19-18(20,21)13-9-16(24)22-15-10-14-11(8-12(13)15)4-7-17(23-14)5-2-1-3-6-17/h8-10,23H,1-7H2,(H,22,24)
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| InChIKey |
FJUPCQHIHYXXFT-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: PT01172, Progesterone receptor