COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK112430
Chemical Name: 4-[(Z)-{3-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl]benzoicacid
Smiles: O=C(CN1C(=O)S/C(=C\c2ccc(cc2)C(=O)O)/C1=O)Nc1ccc2c(c1)OCO2

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Molecular Weight: 426.41
Empirical Formula: C20H14N2O7S

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 3.262
Rotatable bonds: 3
H-donors: 2
H-acceptors: 7
PSA: 147
Number of rings: 4

     

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