COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK285321
Chemical Name: (2Z)-3-[3,5-diiodo-4-(prop-2-yn-1-yloxy)phenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Smiles: C#CCOc1c(I)cc(cc1I)/C=C(\c1[nH]c2c(n1)cc(c(c2)C)C)/C#N

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Molecular Weight: 579.18
Empirical Formula: C21H15I2N3O

Physical State: Dry powder
Available Amount: 122 mg

Lipinsky:
logP: 6.693
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 61
Number of rings: 3

     

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