General Information of the Compound
| Compound ID |
CP0491197
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| Compound Name |
2-(2-(1-acetyl-4-phenylpiperidin-4-yl)-4-(4-chlorophenyl)thiazol-5-yl)acetic acid
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| Structure |
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| Formula |
C24H23ClN2O3S
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| Molecular Weight |
454.979
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| Canonical SMILES |
CC(=O)N1CCC(CC1)(c1nc(c(CC(O)=O)s1)-c1ccc(Cl)cc1)c1ccccc1
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| InChI |
InChI=1S/C24H23ClN2O3S/c1-16(28)27-13-11-24(12-14-27,18-5-3-2-4-6-18)23-26-22(20(31-23)15-21(29)30)17-7-9-19(25)10-8-17/h2-10H,11-15H2,1H3,(H,29,30)
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| InChIKey |
KCGZQDCIVWKSRJ-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