COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL105728
Chemical Name: 8-[(2,4-dimethylphenyl)sulfanyl]-2-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Smiles: CCC1CCCCN1C(=O)Cn1nc2n(c1=O)ccnc2Sc1ccc(cc1C)C

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Molecular Weight: 425.55
Empirical Formula: C22H27N5O2S

Available Amount: 0 mg

Lipinsky:
logP: 3.495
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 93
Number of rings: 4

     

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