COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK981188
Chemical Name: 1-ethyl-8,8-dimethyl-5-(4-nitrophenyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
Smiles: CCn1c(=O)[nH]c(=O)c2c1NC1=C(C2c2ccc(cc2)[N+](=O)[O-])C(=O)CC(C1)(C)C

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Molecular Weight: 410.43
Empirical Formula: C21H22N4O5

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 1.186
Rotatable bonds: 1
H-donors: 2
H-acceptors: 5
PSA: 124
Number of rings: 4

     

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