COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK289360
Chemical Name: (2E)-1-(azepan-1-yl)-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-one
Smiles: COc1c(/C=C/C(=O)N2CCCCCC2)ccc(c1OC)OC

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Molecular Weight: 319.4
Empirical Formula: C18H25NO4

Physical State: Dry powder
Available Amount: 134 mg

Lipinsky:
logP: 2.923
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 48
Number of rings: 2

     

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