General Information of the Compound
| Compound ID |
CP0277694
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| Compound Name |
3-[(2-fluorophenyl)sulfonyl]-1-piperidin-3-yl-1Hpyrrolo[2,3-b]pyridine
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| Structure |
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| Formula |
C18H18FN3O2S
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| Molecular Weight |
359.426
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| Canonical SMILES |
Fc1ccccc1S(=O)(=O)c1cn(C2CCCNC2)c2ncccc12
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| InChI |
InChI=1S/C18H18FN3O2S/c19-15-7-1-2-8-16(15)25(23,24)17-12-22(13-5-3-9-20-11-13)18-14(17)6-4-10-21-18/h1-2,4,6-8,10,12-13,20H,3,5,9,11H2
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| InChIKey |
RBISNFWRLAJWTP-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