General Information of the Compound
| Compound ID |
CP0400167
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| Compound Name |
1-(3-fluorophenyl)sulfonyl-5-pyridin-3-yl-2,3-dihydroindole
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| Structure |
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| Formula |
C19H15FN2O2S
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| Molecular Weight |
354.406
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| Canonical SMILES |
Fc1cccc(c1)S(=O)(=O)N1CCc2cc(ccc12)-c1cccnc1
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| InChI |
InChI=1S/C19H15FN2O2S/c20-17-4-1-5-18(12-17)25(23,24)22-10-8-15-11-14(6-7-19(15)22)16-3-2-9-21-13-16/h1-7,9,11-13H,8,10H2
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| InChIKey |
QWRCBOXJYWTVIU-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: PT03119, Cytochrome P450 11B1, mitochondrial
Protein ID: PT03120, Cytochrome P450 11B2, mitochondrial