COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL405478
Chemical Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-4-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: Cc1nc2n(nc(c2c(c1)c1nnc(n1C)SCC(=O)c1ccc2c(c1)OCCO2)C)c1ccccc1

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Molecular Weight: 512.59
Empirical Formula: C27H24N6O3S

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 5.995
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 122
Number of rings: 6

     

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