COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418585
Chemical Name: (5E)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(3-nitrophenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2cc(n(c2C)c2ccccc2)C)/C(=O)N1c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 435.53
Empirical Formula: C22H17N3O3S2

Physical State: Dry powder
Available Amount: 81 mg

Lipinsky:
logP: 5.968
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 128
Number of rings: 4

     

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