COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169832
Chemical Name: 6-(3,5-dibromo-2-ethoxyphenyl)-3-(pentylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Smiles: CCCCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1cc(Br)cc(c1OCC)Br

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Molecular Weight: 580.34
Empirical Formula: C23H24Br2N4O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 7.084
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 94
Number of rings: 4

     

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