COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK390023
Chemical Name: N-{[3-(1,3-benzothiazol-2-yl)-4-hydroxy-5-methylphenyl]carbamothioyl}-2-nitrobenzamide
Smiles: S=C(NC(=O)c1ccccc1[N+](=O)[O-])Nc1cc(C)c(c(c1)c1nc2c(s1)cccc2)O

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Molecular Weight: 464.53
Empirical Formula: C22H16N4O4S2

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 5.424
Rotatable bonds: 3
H-donors: 3
H-acceptors: 4
PSA: 180
Number of rings: 4

     

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