COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK326153
Chemical Name: 10-bromo-6-(4-tert-butylphenyl)-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Smiles: CSc1nnc2c(n1)OC(Nc1c2cc(Br)cc1)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 457.39
Empirical Formula: C21H21BrN4OS

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 5.811
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 85
Number of rings: 4

     

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