COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK443931
Chemical Name: (2E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(5-ethylthiophen-2-yl)prop-2-enamide
Smiles: CCc1ccc(s1)/C=C(/C(=O)NCc1ccc2c(c1)OCO2)\C#N

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Molecular Weight: 340.4
Empirical Formula: C18H16N2O3S

Physical State: Dry powder
Available Amount: 488 mg

Lipinsky:
logP: 3.766
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 99
Number of rings: 3

     

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