COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521246
Chemical Name: 1-[6-(2,6-dichlorophenyl)-3-(ethylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]propan-1-one
Smiles: CCSc1nnc2c(n1)OC(N(c1c2cccc1)C(=O)CC)c1c(Cl)cccc1Cl

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Molecular Weight: 461.37
Empirical Formula: C21H18Cl2N4O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.823
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 93
Number of rings: 4

     

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