COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL126207
Chemical Name: 3-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazine
Smiles: CCCCOc1ccc(cc1)c1nn2c(c1)c1nnc(n1cc2)SCc1ccc2c(c1)OCO2

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Molecular Weight: 473.56
Empirical Formula: C25H23N5O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 6.231
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 100
Number of rings: 6

     

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