COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK980804
Chemical Name: 2-(benzylsulfanyl)-5-(4-fluorophenyl)-8,8-dimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Smiles: Fc1ccc(cc1)C1C2=C(Nc3c1c(=O)[nH]c(n3)SCc1ccccc1)CC(CC2=O)(C)C

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Molecular Weight: 461.56
Empirical Formula: C26H24FN3O2S

Physical State: Dry powder
Available Amount: 111 mg

Lipinsky:
logP: 4.269
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 95
Number of rings: 5

     

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