COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK931076
Chemical Name: methyl(2E)-[(2E)-4-hydroxy-2-{[(4-nitrophenyl)carbonyl]imino}-1,3-thiazol-5(2H)-ylidene]ethanoate
Smiles: COC(=O)/C=C\1/S/C(=N/C(=O)c2ccc(cc2)[N+](=O)[O-])/N=C1O

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Saltdata: 2 DMF
Molecular Weight: 335.3
Empirical Formula: C13H9N3O6S

Physical State: Dry powder
Available Amount: 12 mg

Lipinsky:
logP: 1.612
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 159
Number of rings: 2

     

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