COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK340156
Chemical Name: 1-(azepan-1-yl)-2-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}ethanone
Smiles: COc1cc(ccc1OC)c1nc(SCC(=O)N2CCCCCC2)nc(c1)C(F)(F)F

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Molecular Weight: 455.5
Empirical Formula: C21H24F3N3O3S

Available Amount: 0 mg

Lipinsky:
logP: 4.994
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 89
Number of rings: 3

     

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