COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK918703
Chemical Name: 4-[2-(butan-2-ylsulfanyl)-4,6-dioxo-3,4,5,6,7,8,9,10-octahydropyrimido[4,5-b]quinolin-5-yl]benzonitrile
Smiles: CCC(Sc1nc2NC3=C(C(c2c(=O)[nH]1)c1ccc(cc1)C#N)C(=O)CCC3)C

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Molecular Weight: 406.51
Empirical Formula: C22H22N4O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.255
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 119
Number of rings: 4

     

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