COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK380134
Chemical Name: ethyl3-{[(2E)-2-{[(5-bromofuran-2-yl)carbonyl]amino}-3-(3-nitrophenyl)prop-2-enoyl]amino}benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccc(o1)Br

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Molecular Weight: 528.32
Empirical Formula: C23H18BrN3O7

Physical State: Dry powder
Available Amount: 245 mg

Lipinsky:
logP: 4.69
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 143
Number of rings: 3

     

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