COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK845258
Chemical Name: 3-ethyl-2-[(4-nitrobenzyl)sulfanyl]-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Smiles: CCn1c(SCc2ccc(cc2)[N+](=O)[O-])nc2c(c1=O)cc1c(n2)CCCC1

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Molecular Weight: 396.47
Empirical Formula: C20H20N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.739
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 116
Number of rings: 4

     

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