COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK808554
Chemical Name: (2E)-2-cyano-3-[4-(dimethylamino)phenyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)N(C)C)/C(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C

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Molecular Weight: 401.47
Empirical Formula: C23H23N5O2

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 2.066
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 79
Number of rings: 3

     

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