COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK860541
Chemical Name: ethyl{[3-cyano-6-oxo-4-(3-phenoxyphenyl)-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1cccc(c1)Oc1ccccc1

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Molecular Weight: 408.48
Empirical Formula: C22H20N2O4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.555
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 3

     

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