COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL043492
Chemical Name: (2Z)-2-(1H-benzimidazol-2-yl)-4-(3,4-dimethoxyphenyl)-3-hydroxybut-2-enenitrile
Smiles: COc1cc(ccc1OC)C/C(=C(/c1nc2c([nH]1)cccc2)\C#N)/O

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Molecular Weight: 335.36
Empirical Formula: C19H17N3O3

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 3.816
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 91
Number of rings: 3

     

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