COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK839710
Chemical Name: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CN1CCN(CC1)C(=O)CCN1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=O

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Molecular Weight: 419.53
Empirical Formula: C19H21N3O4S2

Physical State: Dry powder
Available Amount: 357 mg

Lipinsky:
logP: 1.699
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 119
Number of rings: 4

     

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