COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169860
Chemical Name: 5-bromo-3'-(pentylsulfanyl)-7'H-spiro[indole-3,6'-[1,2,4]triazino[5,6-d][3,1]benzoxazepin]-2(1H)-one
Smiles: CCCCCSc1nnc2c(n1)OC1(Nc3c2cccc3)C(=O)Nc2c1cc(Br)cc2

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Molecular Weight: 498.4
Empirical Formula: C22H20BrN5O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.64
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 5

     

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