COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK980709
Chemical Name: 5-(3,4-dimethoxyphenyl)-2-[(4-methylbenzyl)sulfanyl]-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Smiles: COc1cc(ccc1OC)C1C2=C(CCCC2=O)Nc2c1c(=O)[nH]c(n2)SCc1ccc(cc1)C

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Molecular Weight: 489.6
Empirical Formula: C27H27N3O4S

Physical State: Dry powder
Available Amount: 116 mg

Lipinsky:
logP: 3.382
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 114
Number of rings: 5

     

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