COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169817
Chemical Name: 6-(5-bromo-2-methoxyphenyl)-3-(pentylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Smiles: CCCCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1cc(Br)ccc1OC

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Molecular Weight: 487.42
Empirical Formula: C22H23BrN4O2S

Physical State: Dry powder
Available Amount: 38 mg

Lipinsky:
logP: 6.028
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 94
Number of rings: 4

     

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