COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK046484
Chemical Name: 7-(4-chlorophenyl)-4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: CCOc1ccc(cc1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl)C#N

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Molecular Weight: 448.95
Empirical Formula: C26H25ClN2O3

Physical State: Dry powder
Available Amount: 238 mg

Lipinsky:
logP: 4.317
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 4

     

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