COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK122221
Chemical Name: methyl2-{5-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}-5-bromobenzoate
Smiles: COC(=O)c1cc(Br)ccc1c1ccc(o1)/C=C(/c1nc2c([nH]1)cccc2)\C#N

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Molecular Weight: 448.28
Empirical Formula: C22H14BrN3O3

Physical State: Dry powder
Available Amount: 145 mg

Lipinsky:
logP: 5.86
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 91
Number of rings: 4

     

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