COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL105691
Chemical Name: 2-{8-[(4-chlorobenzyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Smiles: O=C(Cn1nc2n(c1=O)ccnc2SCc1ccc(cc1)Cl)Nc1ccc2c(c1)OCCO2

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Molecular Weight: 483.93
Empirical Formula: C22H18ClN5O4S

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 2.538
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 5

     

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