COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK522171
Chemical Name: 2-methoxy-4-[3-(methylsulfanyl)-7-propanoyl-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]-6-nitrophenylpropanoate
Smiles: CCC(=O)Oc1c(OC)cc(cc1[N+](=O)[O-])C1Oc2nc(SC)nnc2c2c(N1C(=O)CC)cccc2

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Molecular Weight: 525.54
Empirical Formula: C24H23N5O7S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.081
Rotatable bonds: 7
H-donors: 0
H-acceptors: 7
PSA: 174
Number of rings: 4

     

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