COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK757970
Chemical Name: (2E)-2-(1H-benzimidazol-2-yl)-3-[1-(2,4-dichlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]prop-2-enenitrile
Smiles: N#C/C(=C\c1cn(nc1c1ccccc1)Cc1ccc(cc1Cl)Cl)/c1nc2c([nH]1)cccc2

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Saltdata: AcOH(5:2)
Molecular Weight: 470.36
Empirical Formula: C26H17Cl2N5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.63
Rotatable bonds: 3
H-donors: 1
H-acceptors: 0
PSA: 70
Number of rings: 5

     

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