General Information of the Compound
| Compound ID |
CP0287714
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| Compound Name |
3-[(3,5-dichlorophenyl)sulfonyl]-1-(1-methylpiperidin-3-yl)-1H-pyrrolo[2,3-b]pyridine
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| Structure |
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| Formula |
C19H19Cl2N3O2S
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| Molecular Weight |
424.353
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| Canonical SMILES |
CN1CCCC(C1)n1cc(c2cccnc12)S(=O)(=O)c1cc(Cl)cc(Cl)c1
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| InChI |
InChI=1S/C19H19Cl2N3O2S/c1-23-7-3-4-15(11-23)24-12-18(17-5-2-6-22-19(17)24)27(25,26)16-9-13(20)8-14(21)10-16/h2,5-6,8-10,12,15H,3-4,7,11H2,1H3
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| InChIKey |
BHHPHVUPDJBAGA-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