Copper complex with 1,4,7,10-tetrakis(2-cyanolethyl-)-l,4,7,10-tetraazacyclododecane

ID: ALA12043

Max Phase: Preclinical

Molecular Formula: C20H34CuN8O+4

Molecular Weight: 448.08

Molecule Type: Small molecule

Associated Items:

Associated Targets(Human)

BEL-7404 tumor cell line 165 Activities

Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID

Associated Targets(non-human)

P388 20296 Activities

Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID

Molecule Features

Natural Product: NoOral: NoChemical Probe: NoParenteral: No
Molecule Type: Small moleculeTopical: NoFirst In Class: NoBlack Box: No
Chirality: NoAvailability: NoProdrug: No

Drug Indications

MESH IDMESH Heading EFO IDsEFO TermsMax Phase for IndicationReferences

Mechanisms of Action

Mechanism of ActionAction Typetarget IDTarget NameTarget TypeTarget OrganismBinding Site NameReferences

Properties

Molecular Weight: 448.08Molecular Weight (Monoisotopic): 447.2024AlogP: #Rotatable Bonds:
Polar Surface Area: Molecular Species: HBA: HBD:
#RO5 Violations: HBA (Lipinski): HBD (Lipinski): #RO5 Violations (Lipinski):
CX Acidic pKa: CX Basic pKa: CX LogP: CX LogD:
Aromatic Rings: Heavy Atoms: QED Weighted: Np Likeness Score:

References

1. Kong D, Qin C, Meng L, Xie Y..  (1999)  Synthesis, structural characterization and antitumor activity evaluations of copper complex with tetraazamacrocyclic ligand.,  (8): [PMID:10328290] [10.1016/s0960-894x(99)00139-0]

Source