General Information of the Compound
| Compound ID |
CP0935565
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| Compound Name |
2-(5-Amino-2-chloro-phenylamino)-5-quinolin-6-ylmethylene-thiazol-4-one
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| Structure |
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| Formula |
C19H13ClN4OS
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| Molecular Weight |
380.86
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| Canonical SMILES |
Nc1ccc(Cl)c(NC2=NC(=O)/C(=C/c3ccc4ncccc4c3)S2)c1
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| InChI |
InChI=1S/C19H13ClN4OS/c20-14-5-4-13(21)10-16(14)23-19-24-18(25)17(26-19)9-11-3-6-15-12(8-11)2-1-7-22-15/h1-10H,21H2,(H,23,24,25)/b17-9-
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| InChIKey |
NCUXQKKLXYTAQV-MFOYZWKCSA-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