COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK723625
Chemical Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butan-1-one
Smiles: O=C(c1ccc2c(c1)OCCO2)CCCSc1nnc2c(n1)n(C)c1c2cccc1

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Molecular Weight: 420.49
Empirical Formula: C22H20N4O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.177
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 104
Number of rings: 5

     

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