COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK431776
Chemical Name: (2E)-N-(5-chloro-2-methoxyphenyl)-2-cyano-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)prop-2-enamide
Smiles: N#C/C(=C\c1c(C)nn(c1C)CC)/C(=O)Nc1cc(Cl)ccc1OC

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Molecular Weight: 358.83
Empirical Formula: C18H19ClN4O2

Physical State: Dry powder
Available Amount: 874 mg

Lipinsky:
logP: 3.683
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 79
Number of rings: 2

     

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