COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK080214
Chemical Name: (2E)-1-(5,6-dimethyl-1H-benzimidazol-1-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)n2cnc3c2cc(C)c(c3)C)cc(c1OC)OC

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Molecular Weight: 366.42
Empirical Formula: C21H22N2O4

Physical State: Dry powder
Available Amount: 378 mg

Lipinsky:
logP: 4.299
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 62
Number of rings: 3

     

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