COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK465333
Chemical Name: 5-[2-(1,3-benzodioxol-5-yl)quinolin-4-yl]-4-(3-methoxypropyl)-4H-1,2,4-triazole-3-thiol
Smiles: COCCCn1c(S)nnc1c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2

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Molecular Weight: 420.49
Empirical Formula: C22H20N4O3S

Physical State: Dry powder
Available Amount: 332 mg

Lipinsky:
logP: 4.743
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 110
Number of rings: 5

     

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