COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK861899
Chemical Name: 4-[(5E)-5-{[5-(3,4-dichlorophenyl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoicacid
Smiles: OC(=O)CCCN1C(=S)S/C(=C/c2ccc(o2)c2ccc(c(c2)Cl)Cl)/C1=O

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Molecular Weight: 442.34
Empirical Formula: C18H13Cl2NO4S2

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 4.312
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 128
Number of rings: 3

     

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