COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL035207
Chemical Name: 4-[(Z)-(3-{[(2-nitrophenyl)carbonyl]amino}-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzoicacid
Smiles: S=C1S/C(=C\c2ccc(cc2)C(=O)O)/C(=O)N1NC(=O)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 429.43
Empirical Formula: C18H11N3O6S2

Physical State: Dry powder
Available Amount: 39 mg

Lipinsky:
logP: 2.871
Rotatable bonds: 3
H-donors: 2
H-acceptors: 6
PSA: 189
Number of rings: 3

     

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