COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK679898
Chemical Name: ethyl3-{[(6-bromo-8-methoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-3-(3-nitrophenyl)propanoate
Smiles: CCOC(=O)CC(c1cccc(c1)[N+](=O)[O-])NC(=O)c1cc2cc(Br)cc(c2oc1=O)OC

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Molecular Weight: 519.31
Empirical Formula: C22H19BrN2O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.923
Rotatable bonds: 8
H-donors: 1
H-acceptors: 8
PSA: 136
Number of rings: 3

     

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