COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK622969
Chemical Name: (5E)-5-(furan-2-ylmethylidene)-3-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)CN1C(=S)S/C(=C/c2ccco2)/C1=O

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Molecular Weight: 443.55
Empirical Formula: C21H21N3O4S2

Physical State: Dry powder
Available Amount: 338 mg

Lipinsky:
logP: 2.316
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 123
Number of rings: 4

     

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