COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL341968
Chemical Name: 3,3-dimethyl-1-{[4-methyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}butan-2-one
Smiles: O=C(C(C)(C)C)CSc1nnc(n1C)c1nccnc1

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Molecular Weight: 291.38
Empirical Formula: C13H17N5OS

Available Amount: 0 mg

Lipinsky:
logP: 2.191
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 98
Number of rings: 2

     

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