COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL023623
Chemical Name: 6-chloro-3-{[4-(3-ethoxypropyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-phenylquinolin-2(1H)-one
Smiles: CCOCCCn1c(nnc1c1ccc(cc1)OC)Sc1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl

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Molecular Weight: 547.08
Empirical Formula: C29H27ClN4O3S

Available Amount: 0 mg

Lipinsky:
logP: 7.599
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 103
Number of rings: 5

     

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