General Information of the Compound
| Compound ID |
CP0389317
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| Compound Name |
N-[[4-[(4-hydroxyphenyl)methyl-phenylsulfamoyl]phenyl]carbamothioyl]quinoline-7-carboxamide
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| Structure |
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| Formula |
C30H24N4O4S2
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| Molecular Weight |
568.68
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| Canonical SMILES |
Oc1ccc(CN(c2ccccc2)S(=O)(=O)c2ccc(NC(=S)NC(=O)c3ccc4cccnc4c3)cc2)cc1
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| InChI |
InChI=1S/C30H24N4O4S2/c35-26-14-8-21(9-15-26)20-34(25-6-2-1-3-7-25)40(37,38)27-16-12-24(13-17-27)32-30(39)33-29(36)23-11-10-22-5-4-18-31-28(22)19-23/h1-19,35H,20H2,(H2,32,33,36,39)
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| InChIKey |
UXUAMHHBGXZNKO-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