General Information of the Compound
| Compound ID |
CP0555393
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| Compound Name |
N-methyl-5-[2-[[(E)-3-(4-pyridin-3-ylphenyl)prop-2-enyl]amino]ethylsulfamoyl]pyridine-2-carboxamide
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| Structure |
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| Formula |
C23H25N5O3S
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| Molecular Weight |
451.552
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| Canonical SMILES |
CNC(=O)c1ccc(cn1)S(=O)(=O)NCCNC\C=C\c1ccc(cc1)-c1cccnc1
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| InChI |
InChI=1S/C23H25N5O3S/c1-24-23(29)22-11-10-21(17-27-22)32(30,31)28-15-14-25-12-2-4-18-6-8-19(9-7-18)20-5-3-13-26-16-20/h2-11,13,16-17,25,28H,12,14-15H2,1H3,(H,24,29)/b4-2+
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| InChIKey |
JIRNEZMFFCSOPQ-DUXPYHPUSA-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