COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL321004
Chemical Name: 3,3'-{[4-(7,7-dimethyl-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinolin-4-yl)phenyl]imino}dipropanenitrile
Smiles: N#CCCN(c1ccc(cc1)C1CC(=O)NC2=C1C(=O)CC(C2)(C)C)CCC#N

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Molecular Weight: 390.49
Empirical Formula: C23H26N4O2

Physical State: Dry powder
Available Amount: 91 mg

Lipinsky:
logP: 1.878
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 96
Number of rings: 3

     

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