COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK972617
Chemical Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylsulfanyl)ethanone
Smiles: O=C(c1ccc2c(c1)OCCO2)CSc1nnc2n1CCCCC2

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Molecular Weight: 345.42
Empirical Formula: C17H19N3O3S

Available Amount: 0 mg

Lipinsky:
logP: 3.242
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 91
Number of rings: 4

     

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