COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK981177
Chemical Name: 1,8,8-trimethyl-5-(4-nitrophenyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
Smiles: O=C1CC(C)(C)CC2=C1C(c1ccc(cc1)[N+](=O)[O-])c1c(N2)n(C)c(=O)[nH]c1=O

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Molecular Weight: 396.4
Empirical Formula: C20H20N4O5

Physical State: Dry powder
Available Amount: 126 mg

Lipinsky:
logP: 0.654
Rotatable bonds: 0
H-donors: 2
H-acceptors: 5
PSA: 124
Number of rings: 4

     

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