General Information of the Compound
| Compound ID |
CP0489141
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| Compound Name |
4-methyl-N-[5-[5-(2-methyl-1-oxo-3H-isoindol-5-yl)thiophen-2-yl]pyridin-3-yl]-1,3-thiazole-5-sulfonamide
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| Structure |
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| Formula |
C22H18N4O3S3
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| Molecular Weight |
482.612
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| Canonical SMILES |
CN1Cc2cc(ccc2C1=O)-c1ccc(s1)-c1cncc(NS(=O)(=O)c2scnc2C)c1
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| InChI |
InChI=1S/C22H18N4O3S3/c1-13-22(30-12-24-13)32(28,29)25-17-8-15(9-23-10-17)20-6-5-19(31-20)14-3-4-18-16(7-14)11-26(2)21(18)27/h3-10,12,25H,11H2,1-2H3
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| InChIKey |
ZMXBQJCKAFGAIY-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