COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK918652
Chemical Name: 5-[3-(benzyloxy)phenyl]-2-(prop-2-en-1-ylsulfanyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Smiles: C=CCSc1nc2NC3=C(C(c2c(=O)[nH]1)c1cccc(c1)OCc1ccccc1)C(=O)CCC3

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Molecular Weight: 471.58
Empirical Formula: C27H25N3O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.807
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 105
Number of rings: 5

     

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