Bioactive Compound Details

BioIDbio198941
NameNone
ChEMBL IDCHEMBL1951930
Molecular FormulaC30H40N4O4
Molecular Weight520.67
Molecular Weight (Monoisotopic)520.305
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms1,8-Bis[2-(Dipropylamino)Acetamido]Anthraquinone
SmilesCCCN(CCC)CC(=O)Nc1cccc2c1C(=O)c1c(NC(=O)CN(CCC)CCC)cccc1C2=O
InchiInChI=1S/C30H40N4O4/c1-5-15-33(16-6-2)19-25(35)31-23-13-9-11-21-27(23)30(38)28-22(29(21)37)12-10-14-24(28)32-26(36)20-34(17-7-3)18-8-4/h9-14H,5-8,15-20H2,1-4H3,(H,31,35)(H,32,36)
Inchi KeyMFBOAJCPWFEDRH-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities6.0
Np Likeness Score-0.61
Records Key['3t']
Records Name['1,8-Bis[2-(dipropylamino)acetamido]anthraquinone']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure