COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK552627
Chemical Name: 2-{[3-cyano-4-(4-hydroxy-3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C2=C(N1)CCCC2=O)c1ccc(c(c1)OC)O

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Molecular Weight: 491.57
Empirical Formula: C26H25N3O5S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 2.355
Rotatable bonds: 6
H-donors: 3
H-acceptors: 5
PSA: 145
Number of rings: 4

     

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