COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK692765
Chemical Name: ethyl(2E)-2-cyano-3-(4,7-dimethoxy-6-propyl-1,3-benzodioxol-5-yl)prop-2-enoate
Smiles: CCOC(=O)/C(=C/c1c(CCC)c(OC)c2c(c1OC)OCO2)/C#N

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Molecular Weight: 347.37
Empirical Formula: C18H21NO6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.537
Rotatable bonds: 8
H-donors: 0
H-acceptors: 6
PSA: 87
Number of rings: 2

     

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