COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049288
Chemical Name: 3-({4-chloro-5-[(E)-{2-[(4-nitrophenyl)carbonyl]hydrazinylidene}methyl]-2-oxo-1,3-thiazol-3(2H)-yl}methyl)benzoicacid
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])N/N=C/c1sc(=O)n(c1Cl)Cc1cccc(c1)C(=O)O

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Molecular Weight: 460.85
Empirical Formula: C19H13ClN4O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.321
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 170
Number of rings: 3

     

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