Bioactive Compound Details

BioIDbio88467
NameRESORCINOL
ChEMBL IDCHEMBL24147
Molecular FormulaC6H6O2
Molecular Weight110.11
Molecular Weight (Monoisotopic)110.0368
TypeSmall molecule
Max PhasePhase 4
Target IDTar64
Target NameNone
SynonymsBENZENE-1,3-DIOL|C.I. OXIDATION BASE 31|C.I.-76505|D.D.D.|FEMA NO. 3589|NSC-1571|RESORCIN|RESORCINOL|RESORCINUM|Resorcinol|TILLODERM
SmilesOc1cccc(O)c1
InchiInChI=1S/C6H6O2/c7-5-2-1-3-6(8)4-5/h1-4,7-8H
Inchi KeyGHMLBKRAJCXXBS-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets49.0
Bioactivities131.0
Np Likeness Score0.66
Records Key['37', '31', 'table 1, 19', 'Benzene-1,3-diol', 'Resorcinol', '3', 'B', '3', '12', 'resorcinol', 'resorcinol', 'Resorcinol', 'resorcinol', '3', 'resorcinol', '6', 'RESORCINOL', 'SID144204691', 'SID144210460', '11', 'RESORCINOL', 'RESORCINOL', 'SID170465462', 'RESORCINOL', 'RESORCINOL', 'RESORCINOL', '42', 'Resorcinol, m-dihydroxybenzene, 3-hydroxyphenol', '3; Resorcinol', 'SID144209615', 'COVC-2288641363', 'SID17389742', '3', 'Resorcinol', 'Resorcinol', 'Table 1,C1R28', '10', 'RESORCINOL', '1, Resorcinol', 'Resorcinol', 'Resorcinol', 'Fig 4, Cpd B', 'RESORCINOL', 'Resorcinol']
Records Name['Benzene-1,3-diol', 'Benzene-1,3-diol', 'resorcinol', 'Benzene-1,3-diol', 'Resorcinol', 'resorcinol', '1,3-dihydroxy benzene', 'resorcinol', 'Benzene-1,3-diol', 'resorcinol', 'resorcinol', 'Resorcinol', 'resorcinol', 'Resorcinol', 'resorcinol', 'resorcinol', 'RESORCINOL', 'SID144204691', 'SID144210460', 'resorcinol', 'RESORCINOL', 'RESORCINOL', 'SID170465462', 'RESORCINOL', 'RESORCINOL', 'RESORCINOL', 'Resorcinol', 'resorcinol', '1,3-dihydroxybenzene', 'SID144209615', 'RESORCINOL', 'SID17389742', 'Resorcinol', 'Resorcinol', 'Resorcinol', 'resorcinol', 'Resorcinol', 'RESORCINOL', '1,3-dihydroxybenzene', 'Resorcinol', 'Resorcinol', 'Resorcinol', 'RESORCINOL', 'Resorcinol']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure