General Information of the Compound
| Compound ID |
CP0574264
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| Compound Name |
1-[(2E)-2-[1-[(2,4-dichlorophenyl)methyl]-5,6-dihydro-4H-indazol-7-ylidene]ethyl]-3-(2-methoxyphenyl)sulfonylurea
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| Structure |
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| Formula |
C24H24Cl2N4O4S
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| Molecular Weight |
535.453
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| Canonical SMILES |
COc1ccccc1S(=O)(=O)NC(=O)NC\C=C1/CCCc2cnn(Cc3ccc(Cl)cc3Cl)c12
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| InChI |
InChI=1S/C24H24Cl2N4O4S/c1-34-21-7-2-3-8-22(21)35(32,33)29-24(31)27-12-11-16-5-4-6-17-14-28-30(23(16)17)15-18-9-10-19(25)13-20(18)26/h2-3,7-11,13-14H,4-6,12,15H2,1H3,(H2,27,29,31)/b16-11+
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| InChIKey |
RYAIESRONUNAIG-LFIBNONCSA-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