COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK706630
Chemical Name: (2Z)-3-[3-(4-butoxy-3-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile
Smiles: CCCCOc1ccc(cc1Cl)c1nn(cc1/C=C(\c1nc2ccccc2c(=O)[nH]1)/C#N)c1ccccc1

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Molecular Weight: 522.01
Empirical Formula: C30H24ClN5O2

Physical State: Dry powder
Available Amount: 398 mg

Lipinsky:
logP: 7.077
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 92
Number of rings: 5

     

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