COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK843361
Chemical Name: 2-{[3-cyano-6-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N,N-diethylacetamide
Smiles: CCN(C(=O)CSC1=C(C#N)C(CC(=O)N1)c1cc(OC)c(c(c1)OC)OC)CC

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Molecular Weight: 433.53
Empirical Formula: C21H27N3O5S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 2.61
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 126
Number of rings: 2

     

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