COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK173011
Chemical Name: N-{[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]carbamothioyl}-4-methyl-3-nitrobenzamide
Smiles: S=C(NC(=O)c1ccc(c(c1)[N+](=O)[O-])C)Nc1ccc(c(c1)c1nc2c(s1)cccc2)O

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Molecular Weight: 464.53
Empirical Formula: C22H16N4O4S2

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.838
Rotatable bonds: 3
H-donors: 3
H-acceptors: 4
PSA: 180
Number of rings: 4

     

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