COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK706896
Chemical Name: (2Z)-2-(1H-benzimidazol-2-yl)-3-[1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl]prop-2-enenitrile
Smiles: CCCOc1cccc(c1)c1nn(cc1/C=C(\c1nc2c([nH]1)cccc2)/C#N)c1ccccc1

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Molecular Weight: 445.52
Empirical Formula: C28H23N5O

Physical State: Dry powder
Available Amount: 401 mg

Lipinsky:
logP: 6.842
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 79
Number of rings: 5

     

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