COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK918674
Chemical Name: 2-[(4-methylbenzyl)sulfanyl]-5-[2-(trifluoromethyl)phenyl]-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Smiles: Cc1ccc(cc1)CSc1nc2NC3=C(C(c2c(=O)[nH]1)c1ccccc1C(F)(F)F)C(=O)CCC3

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Molecular Weight: 497.54
Empirical Formula: C26H22F3N3O2S

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 4.216
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 95
Number of rings: 5

     

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