COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK864099
Chemical Name: N-{[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]carbamothioyl}-4-ethoxy-3-nitrobenzamide
Smiles: CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc(c(c1)c1nc2c(s1)cccc2)O

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Molecular Weight: 494.55
Empirical Formula: C23H18N4O5S2

Physical State: Dry powder
Available Amount: 339 mg

Lipinsky:
logP: 5.942
Rotatable bonds: 5
H-donors: 3
H-acceptors: 5
PSA: 189
Number of rings: 4

     

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