COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK157258
Chemical Name: (2E,5Z)-2-[(3-bromophenyl)imino]-5-(2-nitrobenzylidene)-1,3-thiazolidin-4-one
Smiles: Brc1cccc(c1)/N=C\1/S/C(=C\c2ccccc2[N+](=O)[O-])/C(=O)N1

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Molecular Weight: 404.24
Empirical Formula: C16H10BrN3O3S

Physical State: Dry powder
Available Amount: 113 mg

Lipinsky:
logP: 2.842
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 3

     

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