COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673219
Chemical Name: ethyl2-amino-7,7-dimethyl-1-(4-nitrophenyl)-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(N)N(C2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CC(C2)(C)C)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 551.6
Empirical Formula: C29H33N3O8

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 2.949
Rotatable bonds: 5
H-donors: 2
H-acceptors: 8
PSA: 146
Number of rings: 4

     

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