COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL403109
Chemical Name: 1-(4-{4-[(4-nitro-1H-pyrazol-3-yl)carbonyl]piperazin-1-yl}phenyl)ethanone
Smiles: O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN(CC1)c1ccc(cc1)C(=O)C

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Molecular Weight: 343.34
Empirical Formula: C16H17N5O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: -0.652
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 115
Number of rings: 3

     

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