COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK080826
Chemical Name: (2Z)-3-(3-chloro-5-methyl-1-phenyl-1H-pyrazol-4-yl)-2-(4-nitrophenyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1c(Cl)nn(c1C)c1ccccc1)/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 364.79
Empirical Formula: C19H13ClN4O2

Physical State: Dry powder
Available Amount: 208 mg

Lipinsky:
logP: 5.299
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 87
Number of rings: 3

     

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