COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521250
Chemical Name: 1-[6-(2,6-dichlorophenyl)-3-(methylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]propan-1-one
Smiles: CSc1nnc2c(n1)OC(c1c(Cl)cccc1Cl)N(c1c2cccc1)C(=O)CC

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Molecular Weight: 447.34
Empirical Formula: C20H16Cl2N4O2S

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 5.292
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 93
Number of rings: 4

     

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