Bioactive Compound Details

BioIDbio198918
NameNone
ChEMBL IDCHEMBL244986
Molecular FormulaC18H20N6O
Molecular Weight336.4
Molecular Weight (Monoisotopic)336.1699
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms4,4'-Di(2-Imidazolidinylimino)Diphenyl Ether
Smilesc1cc(Oc2ccc(NC3=NCCN3)cc2)ccc1NC1=NCCN1
InchiInChI=1S/C18H20N6O/c1-5-15(6-2-13(1)23-17-19-9-10-20-17)25-16-7-3-14(4-8-16)24-18-21-11-12-22-18/h1-8H,9-12H2,(H2,19,20,23)(H2,21,22,24)
Inchi KeyLCPAFKZCFFLTPB-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities12.0
Np Likeness Score-0.38
Records Key['2b', '3b']
Records Name[4,4'-di(2-imidazolidinylimino)diphenyl ether", 'N-{4-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenoxy]phenyl}-4,5-dihydro-1H-imidazol-2-amine']"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure