COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK361980
Chemical Name: 2-({(2E)-2-cyano-3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]prop-2-enoyl}amino)benzoicacid
Smiles: N#C/C(=C\c1ccc(o1)c1ccc(cc1C)[N+](=O)[O-])/C(=O)Nc1ccccc1C(=O)O

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Molecular Weight: 417.38
Empirical Formula: C22H15N3O6

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 5.667
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 149
Number of rings: 3

     

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