COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK509730
Chemical Name: 1-[6-(3-chloro-4-nitrophenyl)-3-(methylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone
Smiles: CSc1nnc2c(n1)OC(c1ccc(c(c1)Cl)[N+](=O)[O-])N(c1c2cccc1)C(=O)C

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Molecular Weight: 443.87
Empirical Formula: C19H14ClN5O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.675
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 139
Number of rings: 4

     

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