COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK287162
Chemical Name: (2Z)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)-3-(3-iodo-5-methoxy-4-propoxyphenyl)prop-2-enenitrile
Smiles: CCCOc1c(I)cc(cc1OC)/C=C(\c1[nH]c2c(n1)cc(c(c2)C)C)/C#N

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Molecular Weight: 487.34
Empirical Formula: C22H22IN3O2

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 6.694
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 70
Number of rings: 3

     

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