COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK822085
Chemical Name: (5Z)-3-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\c2ccc(o2)c2ccccc2[N+](=O)[O-])/C(=O)N1C1CCS(=O)(=O)C1

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Molecular Weight: 450.52
Empirical Formula: C18H14N2O6S3

Physical State: Dry powder
Available Amount: 399 mg

Lipinsky:
logP: 1.712
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 179
Number of rings: 4

     

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