General Information of the Compound
| Compound ID |
CP0574877
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| Compound Name |
N-[5-[5-(2-methyl-1-oxo-3H-isoindol-5-yl)thiophen-2-yl]pyridin-3-yl]-4-(1,3-oxazol-5-yl)benzenesulfonamide
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| Structure |
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| Formula |
C27H20N4O4S2
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| Molecular Weight |
528.615
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| Canonical SMILES |
CN1Cc2cc(ccc2C1=O)-c1ccc(s1)-c1cncc(NS(=O)(=O)c2ccc(cc2)-c2cnco2)c1
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| InChI |
InChI=1S/C27H20N4O4S2/c1-31-15-20-10-18(4-7-23(20)27(31)32)25-8-9-26(36-25)19-11-21(13-28-12-19)30-37(33,34)22-5-2-17(3-6-22)24-14-29-16-35-24/h2-14,16,30H,15H2,1H3
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| InChIKey |
MXVWPRVNVCRAJU-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