COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045465
Chemical Name: (5Z)-3-benzyl-5-{[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\c2ccc(o2)c2ccc(cc2Br)[N+](=O)[O-])/C(=O)N1Cc1ccccc1

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Molecular Weight: 501.38
Empirical Formula: C21H13BrN2O4S2

Physical State: Dry powder
Available Amount: 386 mg

Lipinsky:
logP: 5.098
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 136
Number of rings: 4

     

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