COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK163833
Chemical Name: (2E)-N-{[3-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl}-3-(3-nitrophenyl)prop-2-enamide
Smiles: O=C(NC(=S)Nc1cccc(c1)c1nc2c(s1)cccc2)/C=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 460.54
Empirical Formula: C23H16N4O3S2

Physical State: Dry powder
Available Amount: 424 mg

Lipinsky:
logP: 6.087
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 160
Number of rings: 4

     

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