General Information of the Compound
| Compound ID |
CP0404270
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| Compound Name |
(2R,4R)-2-(2-chlorophenyl)-3-[4-(2-chlorophenyl)benzoyl]-1,3-thiazolidine-4-carboxylic acid
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| Structure |
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| Formula |
C23H17Cl2NO3S
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| Molecular Weight |
458.366
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| Canonical SMILES |
OC(=O)[C@@H]1CS[C@@H](N1C(=O)c1ccc(cc1)-c1ccccc1Cl)c1ccccc1Cl
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| InChI |
InChI=1S/C23H17Cl2NO3S/c24-18-7-3-1-5-16(18)14-9-11-15(12-10-14)21(27)26-20(23(28)29)13-30-22(26)17-6-2-4-8-19(17)25/h1-12,20,22H,13H2,(H,28,29)/t20-,22+/m0/s1
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| InChIKey |
BQPWALNBTMBIJR-RBBKRZOGSA-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