General Information of the Compound
| Compound ID |
CP0519083
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| Compound Name |
2,4-difluoro-N-[5-[5-(6-methyl-7-oxo-5H-pyrrolo[3,4-b]pyridin-3-yl)thiophen-2-yl]pyridin-3-yl]benzenesulfonamide
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| Structure |
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| Formula |
C23H16F2N4O3S2
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| Molecular Weight |
498.536
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| Canonical SMILES |
CN1Cc2cc(cnc2C1=O)-c1ccc(s1)-c1cncc(NS(=O)(=O)c2ccc(F)cc2F)c1
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| InChI |
InChI=1S/C23H16F2N4O3S2/c1-29-12-15-6-13(10-27-22(15)23(29)30)19-3-4-20(33-19)14-7-17(11-26-9-14)28-34(31,32)21-5-2-16(24)8-18(21)25/h2-11,28H,12H2,1H3
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| InChIKey |
FPTRZWCNYNFTIS-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