COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK835723
Chemical Name: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-[4-(diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCN(c1ccc(cc1)N1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=O)CC

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Molecular Weight: 412.53
Empirical Formula: C21H20N2O3S2

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 5.75
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 99
Number of rings: 4

     

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