COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK287242
Chemical Name: propan-2-yl{4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy}acetate
Smiles: COc1cc(ccc1OCC(=O)OC(C)C)/C=C(/c1nc2c([nH]1)cccc2)\C#N

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Molecular Weight: 391.43
Empirical Formula: C22H21N3O4

Physical State: Dry powder
Available Amount: 397 mg

Lipinsky:
logP: 3.94
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 97
Number of rings: 3

     

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