COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380614
Chemical Name: 2-[2-{(E)-[3-(3-bromophenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-5-(diethylamino)phenoxy]-N-(3-nitrophenyl)acetamide
Smiles: CCN(c1ccc(c(c1)OCC(=O)Nc1cccc(c1)[N+](=O)[O-])/C=C\1/SC(=S)N(C1=O)c1cccc(c1)Br)CC

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Molecular Weight: 641.57
Empirical Formula: C28H25BrN4O5S2

Physical State: Dry powder
Available Amount: 550 mg

Lipinsky:
logP: 7.769
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 165
Number of rings: 4

     

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