COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK326302
Chemical Name: 10-bromo-3-(pentylsulfanyl)-6-(pyridin-3-yl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Smiles: CCCCCSc1nnc2c(n1)OC(Nc1c2cc(Br)cc1)c1cccnc1

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Molecular Weight: 458.38
Empirical Formula: C20H20BrN5OS

Physical State: Dry powder
Available Amount: 178 mg

Lipinsky:
logP: 4.755
Rotatable bonds: 6
H-donors: 1
H-acceptors: 1
PSA: 98
Number of rings: 4

     

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