COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK014615
Chemical Name: N-{[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]carbamothioyl}-4-methoxy-3-nitrobenzamide
Smiles: COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc(c(c1)c1nc2c(s1)cccc2)Cl

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Molecular Weight: 498.97
Empirical Formula: C22H15ClN4O4S2

Physical State: Dry powder
Available Amount: 195 mg

Lipinsky:
logP: 5.718
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 169
Number of rings: 4

     

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