General Information of the Compound
| Compound ID |
CP0393742
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| Compound Name |
(R)-2-Methyl-5-trifluoromethyl-1,2,3,8-tetrahydro-pyrrolo[3,2-g]quinolin-7-one
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| Structure |
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| Formula |
C13H11F3N2O
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| Molecular Weight |
268.238
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| Canonical SMILES |
C[C@@H]1Cc2cc3c(cc(=O)[nH]c3cc2N1)C(F)(F)F
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| InChI |
InChI=1S/C13H11F3N2O/c1-6-2-7-3-8-9(13(14,15)16)4-12(19)18-11(8)5-10(7)17-6/h3-6,17H,2H2,1H3,(H,18,19)/t6-/m1/s1
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| InChIKey |
UDMCMALCRGIISA-ZCFIWIBFSA-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