General Information of the Compound
| Compound ID |
CP0294388
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| Compound Name |
3-[(3,5-dichlorophenyl)sulfonyl]-1-piperidin-3-yl-1H-pyrrolo[2,3-b]pyridine
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| Structure |
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| Formula |
C18H17Cl2N3O2S
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| Molecular Weight |
410.326
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| Canonical SMILES |
Clc1cc(Cl)cc(c1)S(=O)(=O)c1cn(C2CCCNC2)c2ncccc12
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| InChI |
InChI=1S/C18H17Cl2N3O2S/c19-12-7-13(20)9-15(8-12)26(24,25)17-11-23(14-3-1-5-21-10-14)18-16(17)4-2-6-22-18/h2,4,6-9,11,14,21H,1,3,5,10H2
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| InChIKey |
FIACVOPAQZIBSC-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