COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL174862
Chemical Name: 2-amino-1-(4-chloro-2-nitrophenyl)-4-(4-ethoxyphenyl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: CCOc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CC(C2)c1ccccc1)c1ccc(cc1[N+](=O)[O-])Cl)C#N

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Molecular Weight: 541.01
Empirical Formula: C30H25ClN4O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.052
Rotatable bonds: 1
H-donors: 2
H-acceptors: 4
PSA: 125
Number of rings: 5

     

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