COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK426900
Chemical Name: N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,3-benzodioxole-5-carboxamide
Smiles: CCC(C1CCc2c(C1)sc(c2C#N)NC(=O)c1ccc2c(c1)OCO2)(C)C

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Molecular Weight: 396.51
Empirical Formula: C22H24N2O3S

Physical State: Dry powder
Available Amount: 2395 mg

Lipinsky:
logP: 5.893
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 99
Number of rings: 4

     

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