COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK605953
Chemical Name: methyl4-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-1-(1,1-dioxidotetrahydrothiophen-3-yl)-4,5-dioxopyrrolidin-2-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1C1CCS(=O)(=O)C1

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Molecular Weight: 489.93
Empirical Formula: C23H20ClNO7S

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: 2.564
Rotatable bonds: 3
H-donors: 1
H-acceptors: 7
PSA: 126
Number of rings: 4

     

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