General Information of the Compound
| Compound ID |
CP0291486
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| Compound Name |
2-(2-amino-3-(2-(2-chloro-4-hydroxyphenyl)thiazol-5-yl)propanamido)benzoic acid
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| Structure |
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| Formula |
C19H16ClN3O4S
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| Molecular Weight |
417.874
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| Canonical SMILES |
NC(Cc1cnc(s1)-c1ccc(O)cc1Cl)C(=O)Nc1ccccc1C(O)=O
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| InChI |
InChI=1S/C19H16ClN3O4S/c20-14-7-10(24)5-6-12(14)18-22-9-11(28-18)8-15(21)17(25)23-16-4-2-1-3-13(16)19(26)27/h1-7,9,15,24H,8,21H2,(H,23,25)(H,26,27)
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| InChIKey |
XGHLSBKJJVJKFA-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