COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL105727
Chemical Name: N-butyl-2-{8-[(2,4-dimethylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-ethylacetamide
Smiles: CCCCN(C(=O)Cn1nc2n(c1=O)ccnc2Sc1ccc(cc1C)C)CC

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Molecular Weight: 413.54
Empirical Formula: C21H27N5O2S

Physical State: Dry powder
Available Amount: 119 mg

Lipinsky:
logP: 3.12
Rotatable bonds: 8
H-donors: 0
H-acceptors: 2
PSA: 93
Number of rings: 3

     

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