COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK801152
Chemical Name: (2E)-2-cyano-3-(3-{4-[(2,4-dichlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)-N-(4-methylphenyl)prop-2-enamide
Smiles: N#C/C(=C\c1cn(nc1c1ccc(cc1)OCc1ccc(cc1Cl)Cl)c1ccccc1)/C(=O)Nc1ccc(cc1)C

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Molecular Weight: 579.48
Empirical Formula: C33H24Cl2N4O2

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 8.573
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 79
Number of rings: 5

     

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