Bioactive Compound Details

BioIDbio198832
NameNone
ChEMBL IDCHEMBL1951922
Molecular FormulaC26H32N4O4
Molecular Weight464.57
Molecular Weight (Monoisotopic)464.2424
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms1,8-Bis[2-(Isobutylamino)Acetamido]Anthraquinone
SmilesCC(C)CNCC(=O)Nc1cccc2c1C(=O)c1c(NC(=O)CNCC(C)C)cccc1C2=O
InchiInChI=1S/C26H32N4O4/c1-15(2)11-27-13-21(31)29-19-9-5-7-17-23(19)26(34)24-18(25(17)33)8-6-10-20(24)30-22(32)14-28-12-16(3)4/h5-10,15-16,27-28H,11-14H2,1-4H3,(H,29,31)(H,30,32)
Inchi KeyVPIFECRMCRRBPF-UHFFFAOYSA-N
Molecular SpeciesBASE
Targets2.0
Bioactivities6.0
Np Likeness Score-0.38
Records Key['3l']
Records Name['1,8-Bis[2-(isobutylamino)acetamido]anthraquinone']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure