COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK702673
Chemical Name: (2E)-2-(1H-benzimidazol-2-yl)-3-{1-phenyl-3-[4-(propan-2-yloxy)phenyl]-1H-pyrazol-4-yl}prop-2-enenitrile
Smiles: N#C/C(=C\c1cn(nc1c1ccc(cc1)OC(C)C)c1ccccc1)/c1nc2c([nH]1)cccc2

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Molecular Weight: 445.52
Empirical Formula: C28H23N5O

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 6.708
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 79
Number of rings: 5

     

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