COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK464532
Chemical Name: N-(2-methoxyethyl)-4-[(4-nitrophenyl)sulfonyl]piperazine-1-carbothioamide
Smiles: COCCNC(=S)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 388.47
Empirical Formula: C14H20N4O5S2

Physical State: Dry powder
Available Amount: 245 mg

Lipinsky:
logP: 1.046
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 148
Number of rings: 2

     

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