Bioactive Compound Details

BioIDbio22
NamePHENOL
ChEMBL IDCHEMBL14060
Molecular FormulaC6H6O
Molecular Weight94.11
Molecular Weight (Monoisotopic)94.0419
TypeSmall molecule
Max PhasePhase 4
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonyms2-ALLPHENOL|CARBOLIC ACID|CARBOLICUM ACIDUM|CHLORASEPTIC|ENT-1814|LIQUEFIED PHENOL|LIQUIFIED PHENOL|NSC-36808|PHENIC ACID|PHENOL|PHENOL, LIQUEFIED|PHENOL, LIQUIFIED|PHENOL,LIQUIFIED|PHENYLIC ALCOHOL|Phenol|S.B. WARD|SALICYLIC ACID RELATED COMPOUND C
SmilesOc1ccccc1
InchiInChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H
Inchi KeyISWSIDIOOBJBQZ-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets172.0
Bioactivities548.0
Np Likeness Score0.42
Records Key['135', '1', 'Phenol', '1', '38', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'table 4, ligand 8', 'Phenol', 'phenol', '1', '1', '3', 'Phenol', '27', 'Phenol', 'S34, r1c1', 'table 1, 9', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Table 3, R49C1', '83', 'Phenol', '26', 'phenol', '1', 'Phenol', 'phenol', '49', '80', 'SID17389767', 'Phenol', 'PHENOL', '10', '1', 'phenol', 'SID26753013', 'Phenol', 'phenol', 'SID170465486', '12', '1', 'Phenol', 'phenol', 'SID26753012', '5', 'phenol 10000 micromolar', 'PhOH', 'PHENOL', '17', 'PHENOL', '3', 'COVC-2825512356', '21g', 'Phenol', 'Phenol', 'SID144208837', 'SID144210362', 'SID144207012', '6', 'phenol', 'Table I, R20C1', 'phenol', 'PHENOL', 'Phenol', 'phenol', 'Table 1, C1R25', '1; Phenol', 'phenol', '1', 'Phenol', 'PHENOL', 'Table V, 1', 'phenol', 'PHENOL', 'Phenol', 'Phenol', 'phenol', 'Phenol', 'phenol']
Records Name['Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'phenol', 'phenol', 'Phenol', 'Phenol', 'Phenol', 'Phenol', 'phenol', 'Phenol', 'Phenol', 'Phenol', 'phenol', 'phenol', 'Phenol', 'phenol', 'Phenol', 'phenol', 'SID17389767', 'Phenol', 'PHENOL', 'phenol', 'phenol', 'phenol', 'SID26753013', 'Phenol', 'phenol', 'SID170465486', 'Phenol', 'Phenol', 'Phenol', 'phenol', 'SID26753012', 'phenol', 'phenol', 'Phenol', 'PHENOL', 'Phenol', 'Phenol', 'phenol', 'PHENOL', 'phenol', 'Phenol', 'Phenol', 'SID144208837', 'SID144210362', 'SID144207012', 'Phenol', 'phenol', 'phenol', 'phenol', 'PHENOL', 'Phenol', 'Phenol', 'phenol', '1-hydroxybenzene', 'phenol', 'Phenol', 'Phenol', 'PHENOL', 'Phenol', 'phenol', 'PHENOL', 'Phenol', 'Phenol', 'phenol', 'Phenol', 'phenol']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure