General Information of the Compound
| Compound ID |
CP0383004
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| Compound Name |
2-(2-(3,4-dimethoxybenzyl)-4-phenylthiazol-5-yl)acetic acid
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| Structure |
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| Formula |
C20H19NO4S
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| Molecular Weight |
369.442
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| Canonical SMILES |
COc1ccc(Cc2nc(c(CC(O)=O)s2)-c2ccccc2)cc1OC
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| InChI |
InChI=1S/C20H19NO4S/c1-24-15-9-8-13(10-16(15)25-2)11-18-21-20(14-6-4-3-5-7-14)17(26-18)12-19(22)23/h3-10H,11-12H2,1-2H3,(H,22,23)
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| InChIKey |
DEZSAVMEIHHGQZ-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