4-Oxo-4-[(4-phenoxyphenyl)amino]butanoic acid
AlkaPlorer ID: AK485347
Synonym: None
IUPAC Name: 4-oxo-4-(4-phenoxyanilino)butanoic acid
Structure
SMILES: O=C(O)CCC(=O)NC1=CC=C(OC2=CC=CC=C2)C=C1
InChI: InChI=1S/C16H15NO4/c18-15(10-11-16(19)20)17-12-6-8-14(9-7-12)21-13-4-2-1-3-5-13/h1-9H,10-11H2,(H,17,18)(H,19,20)
InChIKey: OZZUFAXFPXXPPS-UHFFFAOYSA-N
Reference
PubChem CID: 683808
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 285.29900000000004
TPSA？: 75.63
MolLogP？: 3.2822000000000013
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Neisseria meningitidis | Biliverdin-producing heme oxygenase | Inhibition | nan | % | None |
| Neisseria meningitidis | Biliverdin-producing heme oxygenase | Kd | nan | None | None |
| Pseudomonas aeruginosa | Heme oxygenase | Activity | nan | None | None |
| Pseudomonas aeruginosa | Heme oxygenase | Kd | nan | None | None |
| Pseudomonas aeruginosa | Pseudomonas aeruginosa | MIC50 | nan | None | None |
| None | No relevant target | LogP | 2.36 | None | None |
| None | Unchecked | Inhibition | 1.4 | % | 10.1016/j.bmcl.2017.02.025 |
| None | Unchecked | V0 | 0.73 | microM/s | 10.1016/j.bmcl.2017.02.025 |