COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK525993
Chemical Name: 2-({4-[(5E)-5-(3-{4-[(2-carboxyphenyl)amino]-4-oxobutyl}-2-oxo-4-thioxo-1,3-thiazolidin-5-ylidene)-2-oxo-4-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoicacid
Smiles: O=C(Nc1ccccc1C(=O)O)CCCN1C(=O)S/C(=C\2/SC(=O)N(C2=S)CCCC(=O)Nc2ccccc2C(=O)O)/C1=S

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Molecular Weight: 672.78
Empirical Formula: C28H24N4O8S4

Physical State: Dry powder
Available Amount: 319 mg

Lipinsky:
logP: 4.202
Rotatable bonds: 12
H-donors: 4
H-acceptors: 8
PSA: 288
Number of rings: 4

     

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