COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK230100
Chemical Name: 3,3-dimethyl-1-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)butan-2-one
Smiles: O=C(C(C)(C)C)CSc1nnc2c(n1)[nH]c1c2cccc1

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Molecular Weight: 300.38
Empirical Formula: C15H16N4OS

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 2.891
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 96
Number of rings: 3

     

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