COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK350003
Chemical Name: 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone
Smiles: O=C(N1CCNCC1)Cn1cc(c(n1)[N+](=O)[O-])Cl

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Saltdata: HCl
Molecular Weight: 273.68
Empirical Formula: C9H12ClN5O3

Physical State: Dry powder
Available Amount: 5055 mg

Lipinsky:
logP: -0.046
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 95
Number of rings: 2

     

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