COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK326637
Chemical Name: (2Z,5Z)-5-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-3-(3,4-dimethylphenyl)-2-[(3,4-dimethylphenyl)imino]-1,3-thiazolidin-4-one
Smiles: O=C1/C(=C/c2cc3OCOc3cc2Cl)/S/C(=N\c2ccc(c(c2)C)C)/N1c1ccc(c(c1)C)C

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Molecular Weight: 491.01
Empirical Formula: C27H23ClN2O3S

Physical State: Dry powder
Available Amount: 201 mg

Lipinsky:
logP: 8.669
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 76
Number of rings: 5

     

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