COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK761835
Chemical Name: ethyl2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NS(=O)(=O)c1ccccc1)Nc1sc2c(c1C#N)CCCC2

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Molecular Weight: 487.52
Empirical Formula: C20H20F3N3O4S2

Physical State: Dry powder
Available Amount: 19 mg

Lipinsky:
logP: 8.031
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 144
Number of rings: 3

     

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