COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521569
Chemical Name: 3-[7-acetyl-3-(benzylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]-4-bromophenylacetate
Smiles: CC(=O)Oc1ccc(c(c1)C1Oc2nc(nnc2c2c(N1C(=O)C)cccc2)SCc1ccccc1)Br

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Molecular Weight: 577.46
Empirical Formula: C27H21BrN4O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.679
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 119
Number of rings: 5

     

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