COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK043078
Chemical Name: 2-iodo-N-{[4-(4-nitrophenyl)piperazin-1-yl]carbonothioyl}benzamide
Smiles: S=C(N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])NC(=O)c1ccccc1I

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Molecular Weight: 496.33
Empirical Formula: C18H17IN4O3S

Physical State: Dry powder
Available Amount: 208 mg

Lipinsky:
logP: 3.052
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 113
Number of rings: 3

     

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