COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK755540
Chemical Name: 2-amino-4-(4-ethoxyphenyl)-7,7-dimethyl-1-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: CCOc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CC(C2)(C)C)c1ccc(cc1)[N+](=O)[O-])C#N

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Molecular Weight: 458.52
Empirical Formula: C26H26N4O4

Physical State: Dry powder
Available Amount: 32 mg

Lipinsky:
logP: 3.571
Rotatable bonds: 1
H-donors: 2
H-acceptors: 4
PSA: 125
Number of rings: 4

     

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