COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK980647
Chemical Name: 2-(methylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Smiles: COc1c(OC)cc(cc1OC)C1C2=C(CCCC2=O)Nc2c1c(=O)[nH]c(n2)SC

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Molecular Weight: 429.5
Empirical Formula: C21H23N3O5S

Physical State: Dry powder
Available Amount: 119 mg

Lipinsky:
logP: 0.847
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 123
Number of rings: 4

     

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