COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK880730
Chemical Name: (2Z)-2-(1H-benzimidazol-2-yl)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enenitrile
Smiles: COc1cc(ccc1OC)c1nn(cc1/C=C(\c1nc2c([nH]1)cccc2)/C#N)c1ccccc1

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Molecular Weight: 447.5
Empirical Formula: C27H21N5O2

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 5.501
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 88
Number of rings: 5

     

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