COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK509119
Chemical Name: 2-[7-acetyl-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]-4,6-dibromophenylacetate
Smiles: CSc1nnc2c(n1)OC(c1cc(Br)cc(c1OC(=O)C)Br)N(c1c2cccc1)C(=O)C

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Molecular Weight: 580.26
Empirical Formula: C21H16Br2N4O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.501
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 119
Number of rings: 4

     

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