COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK308176
Chemical Name: {4-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}(4-nitrophenyl)methanone
Smiles: Cn1nc(c(c1)CN1CCN(CC1)C(=O)c1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 343.39
Empirical Formula: C17H21N5O3

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 0.258
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 87
Number of rings: 3

     

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