COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK918766
Chemical Name: 4-{8,8-dimethyl-2-[(3-methylbutyl)sulfanyl]-4,6-dioxo-3,4,5,6,7,8,9,10-octahydropyrimido[4,5-b]quinolin-5-yl}benzonitrile
Smiles: N#Cc1ccc(cc1)C1C2=C(Nc3c1c(=O)[nH]c(n3)SCCC(C)C)CC(CC2=O)(C)C

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Molecular Weight: 448.59
Empirical Formula: C25H28N4O2S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 3.819
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 119
Number of rings: 4

     

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