COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK806071
Chemical Name: propan-2-yl({4-[3-(benzyloxy)-4-methoxyphenyl]-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)acetate
Smiles: N#CC1=C(SCC(=O)OC(C)C)NC(=O)CC1c1ccc(c(c1)OCc1ccccc1)OC

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Molecular Weight: 466.56
Empirical Formula: C25H26N2O5S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.303
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 122
Number of rings: 3

     

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