COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK310236
Chemical Name: 1-{4-[(1,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperazin-1-yl}-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propan-1-one
Smiles: O=C(N1CCN(CC1)S(=O)(=O)c1cnn(c1C)C)CCn1ncc(c1C)[N+](=O)[O-]

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Molecular Weight: 425.47
Empirical Formula: C16H23N7O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0.706
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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