COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL173955
Chemical Name: (2E)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-enamide
Smiles: COc1ccc(cc1COc1ccccc1)/C=C/C(=O)Nc1sc2c(c1C#N)CCCC2

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Molecular Weight: 444.55
Empirical Formula: C26H24N2O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.858
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 99
Number of rings: 4

     

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