COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL105684
Chemical Name: 8-[(4-chlorobenzyl)sulfanyl]-2-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Smiles: Clc1ccc(cc1)CSc1nccn2c1nn(c2=O)CC(=O)N1CCOc2c1cc(C)cc2

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Molecular Weight: 481.96
Empirical Formula: C23H20ClN5O3S

Physical State: Dry powder
Available Amount: 41 mg

Lipinsky:
logP: 3.594
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 103
Number of rings: 5

     

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