COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK808854
Chemical Name: (2E)-3-(2-chloro-6-fluorophenyl)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)prop-2-enamide
Smiles: N#C/C(=C\c1c(F)cccc1Cl)/C(=O)Nc1c(=O)n(n(c1C)C)c1ccccc1

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Molecular Weight: 410.83
Empirical Formula: C21H16ClFN4O2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 1.553
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 76
Number of rings: 3

     

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