COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK981103
Chemical Name: 5-{4-[benzyl(ethyl)amino]phenyl}-2-thioxo-2,3,5,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6(1H,7H)-dione
Smiles: CCN(c1ccc(cc1)C1C2=C(CCCC2=O)Nc2c1c(=O)[nH]c(=S)[nH]2)Cc1ccccc1

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Molecular Weight: 458.58
Empirical Formula: C26H26N4O2S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 3.398
Rotatable bonds: 2
H-donors: 3
H-acceptors: 2
PSA: 105
Number of rings: 5

     

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