COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK719310
Chemical Name: (5Z)-5-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methylidene}-3-(butan-2-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCC(N1C(=S)S/C(=C\N2CCN(CC2)Cc2ccc3c(c2)OCO3)/C1=O)C

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Molecular Weight: 419.57
Empirical Formula: C20H25N3O3S2

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 2.623
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 102
Number of rings: 4

     

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