2AF

2-AMINOPHENOL

Created:	2002-03-19
Last modified:	2011-06-04

Find Related PDB Entry
4 entries where 2AF is found as a standalone ligand

Help Find related ligands:
Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Help

Find related ligands:

Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Chemical Details
Formal Charge	0
Atom Count	15
Chiral Atom Count	0
Bond Count	15
Aromatic Bond Count	6

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	2-AMINOPHENOL
Systematic Name (OpenEye OEToolkits)	2-aminophenol
Formula	C₆ H₇ N O
Molecular Weight	109.126
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	Oc1ccccc1N
SMILES	CACTVS	3.341	Nc1ccccc1O
SMILES	OpenEye OEToolkits	1.5.0	c1ccc(c(c1)N)O
Canonical SMILES	CACTVS	3.341	Nc1ccccc1O
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1ccc(c(c1)N)O
InChI	InChI	1.03	InChI=1S/C6H7NO/c7-5-3-1-2-4-6(5)8/h1-4,8H,7H2
InChIKey	InChI	1.03	CDAWCLOXVUBKRW-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB01726
Name	2-Aminophenol
Groups	experimental
Synonyms	2-Aminophenol
Categories	Amines Aniline Compounds Benzene Derivatives Phenols
CAS number	95-55-6

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase	MQTLHALLRDIPAPDAEAMARAQQHIDGLLKPPGSLGRLETLAVQLAGMP...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682