General Information of the Compound
| Compound ID |
CP0570003
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| Compound Name |
4-(4-chlorophenyl)-2-(quinoline-5-carbonylamino)thiophene-3-carboxylic acid
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| Structure |
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| Formula |
C21H13ClN2O3S
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| Molecular Weight |
408.866
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| Canonical SMILES |
OC(=O)c1c(NC(=O)c2cccc3ncccc23)scc1-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C21H13ClN2O3S/c22-13-8-6-12(7-9-13)16-11-28-20(18(16)21(26)27)24-19(25)15-3-1-5-17-14(15)4-2-10-23-17/h1-11H,(H,24,25)(H,26,27)
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| InChIKey |
DWWFWTYSQYGSDN-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