COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK980733
Chemical Name: 2-[(2-chlorobenzyl)sulfanyl]-5-(4-hydroxy-3-methoxyphenyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Smiles: COc1cc(ccc1O)C1C2=C(CCCC2=O)Nc2c1c(=O)[nH]c(n2)SCc1ccccc1Cl

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Molecular Weight: 495.99
Empirical Formula: C25H22ClN3O4S

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 2.748
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 125
Number of rings: 5

     

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