General Information of the Compound
| Compound ID |
CP0371813
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| Compound Name |
2-(4-(4-chlorophenyl)-2-(naphthalen-1-ylmethyl)thiazol-5-yl)acetic acid
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| Structure |
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| Formula |
C22H16ClNO2S
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| Molecular Weight |
393.895
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| Canonical SMILES |
OC(=O)Cc1sc(Cc2cccc3ccccc23)nc1-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C22H16ClNO2S/c23-17-10-8-15(9-11-17)22-19(13-21(25)26)27-20(24-22)12-16-6-3-5-14-4-1-2-7-18(14)16/h1-11H,12-13H2,(H,25,26)
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| InChIKey |
ITDGDPANJQEAKP-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