COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL064195
Chemical Name: 2-nitro-N-[(3-oxopiperazin-1-yl)carbonothioyl]benzamide
Smiles: O=C1NCCN(C1)C(=S)NC(=O)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 308.32
Empirical Formula: C12H12N4O4S

Physical State: Dry powder
Available Amount: 165 mg

Lipinsky:
logP: -1.831
Rotatable bonds: 1
H-donors: 2
H-acceptors: 4
PSA: 139
Number of rings: 2

     

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