The store will not work correctly when cookies are disabled.
JavaScript seems to be disabled in your browser. For the best experience on our site, be sure to turn on Javascript in your browser.
1,10-phenanthrolin-1-ium hemi-hexafluorophosphate(V) ID: ALA5081058
Chembl Id: CHEMBL5081058
Max Phase: Preclinical
Molecular Formula: C12H9F6N2P
Molecular Weight: 180.21
Molecule Type: Unknown
Associated Items:
Names and Identifiers Canonical SMILES: F[PH](F)(F)(F)(F)F.c1cnc2c(c1)ccc1cccnc12
Standard InChI: InChI=1S/C12H8N2.F6HP/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;1-7(2,3,4,5)6/h1-8H;7H
Standard InChI Key: YKJWZKVBQACITL-UHFFFAOYSA-N
Associated Targets(Human) Associated Targets(non-human) Molecule Features Natural Product: NoOral: NoChemical Probe: NoParenteral: NoMolecule Type: UnknownTopical: NoFirst In Class: NoBlack Box: NoChirality: NoAvailability: NoProdrug: No
Drug Indications MESH ID MESH Heading EFO IDs EFO Terms Max Phase for Indication References
Mechanisms of Action Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References
Calculated Properties Molecular Weight: 180.21Molecular Weight (Monoisotopic): 180.0687AlogP: 2.78#Rotatable Bonds: 0Polar Surface Area: 25.78Molecular Species: NEUTRALHBA: 2HBD: 0#RO5 Violations: 0HBA (Lipinski): 2HBD (Lipinski): 0#RO5 Violations (Lipinski): 0CX Acidic pKa: CX Basic pKa: 4.80CX LogP: 2.29CX LogD: 2.29Aromatic Rings: 3Heavy Atoms: 14QED Weighted: 0.50Np Likeness Score: -0.52
References 1. Zhao Z, Li X, Cui Z, Tong T, Zhang Y, Zhang Y, Yang X, Keerthiga R, Fu C, Fu A.. (2022) Synthesis of Hemiprotonic Phenanthroline-Phenanthroline+ Compounds with both Antitumor and Antimicrobial Activity., 65 (3.0): [PMID:35073076 ] [10.1021/acs.jmedchem.1c01982 ]
