COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK422575
Chemical Name: (2E)-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methylthiophen-2-yl)prop-2-enamide
Smiles: N#C/C(=C\c1sccc1C)/C(=O)NCCc1ccc(c(c1)OC)OC

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Molecular Weight: 356.45
Empirical Formula: C19H20N2O3S

Physical State: Dry powder
Available Amount: 972 mg

Lipinsky:
logP: 3.179
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 99
Number of rings: 2

     

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