COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK765553
Chemical Name: methylN-(6-benzyl-3-cyano-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-3,3,3-trifluoro-2-(propanoylamino)alaninate
Smiles: COC(=O)C(C(F)(F)F)(Nc1sc2c(c1C#N)CCN(C2)Cc1ccccc1)NC(=O)CC

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Molecular Weight: 480.51
Empirical Formula: C22H23F3N4O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.483
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 122
Number of rings: 3

     

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