COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL365335
Chemical Name: 3-[(E)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl4-nitrobenzoate
Smiles: S=C1S/C(=C/c2cccc(c2)OC(=O)c2ccc(cc2)[N+](=O)[O-])/C(=O)N1Cc1ccccc1

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Molecular Weight: 476.53
Empirical Formula: C24H16N2O5S2

Physical State: Dry powder
Available Amount: 1145 mg

Lipinsky:
logP: 5.031
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 149
Number of rings: 4

     

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