COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK460159
Chemical Name: methyl(2Z)-3-[1-(3-chlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-2-cyanoprop-2-enoate
Smiles: N#C/C(=C/c1cn(nc1c1ccccc1)Cc1cccc(c1)Cl)/C(=O)OC

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Molecular Weight: 377.83
Empirical Formula: C21H16ClN3O2

Physical State: Dry powder
Available Amount: 430 mg

Lipinsky:
logP: 3.892
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 67
Number of rings: 3

     

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