COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK245245
Chemical Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)ethanone
Smiles: O=C(c1ccc2c(c1)OCCO2)CSc1nnc[nH]1

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Molecular Weight: 277.3
Empirical Formula: C12H11N3O3S

Physical State: Dry powder
Available Amount: 116 mg

Lipinsky:
logP: 1.222
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 102
Number of rings: 3

     

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