COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK606985
Chemical Name: 4-[2-(4-ethoxy-3-nitrophenyl)-2-oxoethyl]-2-ethyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CCOc1ccc(cc1[N+](=O)[O-])C(=O)CN1C(=O)C(CC)Oc2c(C1=O)cccc2

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Molecular Weight: 412.4
Empirical Formula: C21H20N2O7

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 2.41
Rotatable bonds: 6
H-donors: 0
H-acceptors: 7
PSA: 118
Number of rings: 3

     

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