BDBM81898 (R)-Hexbutinol::(S)-Hexbutinol::CAS_2054312::CAS_2054314::NSC_2054312::NSC_2054314

SMILES OC(C#CCN1CCCCC1)(C1CCCCC1)c1ccccc1

InChI Key InChIKey=IXXCPZGOFVCPCH-UHFFFAOYSA-N

Data  9 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 81898   

TargetMuscarinic acetylcholine receptor M3(Human)
National Institute of Neurological Disorders and Stroke

Curated by PDSP Ki Database
LigandPNGBDBM81898(NSC_2054314 | (R)-Hexbutinol | NSC_2054312 | CAS_2...)
Affinity DataKi:  2.18nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/18/2011
Entry Details
PubMed
TargetMuscarinic acetylcholine receptor M4(Human)
National Institute of Neurological Disorders and Stroke

Curated by PDSP Ki Database
LigandPNGBDBM81898(NSC_2054314 | (R)-Hexbutinol | NSC_2054312 | CAS_2...)
Affinity DataKi:  3.02nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/18/2011
Entry Details
PubMed
TargetMuscarinic acetylcholine receptor M5(Human)
National Institute of Neurological Disorders and Stroke

Curated by PDSP Ki Database
LigandPNGBDBM81898(NSC_2054314 | (R)-Hexbutinol | NSC_2054312 | CAS_2...)
Affinity DataKi:  5.5nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/18/2011
Entry Details
PubMed
TargetMuscarinic acetylcholine receptor M4(Human)
National Institute of Neurological Disorders and Stroke

Curated by PDSP Ki Database
LigandPNGBDBM81898(NSC_2054314 | (R)-Hexbutinol | NSC_2054312 | CAS_2...)
Affinity DataKi:  19.5nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/18/2011
Entry Details
PubMed
TargetMuscarinic acetylcholine receptor M2(Human)
National Institute of Neurological Disorders and Stroke

Curated by PDSP Ki Database
LigandPNGBDBM81898(NSC_2054314 | (R)-Hexbutinol | NSC_2054312 | CAS_2...)
Affinity DataKi:  20.9nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/18/2011
Entry Details
PubMed
TargetMuscarinic acetylcholine receptor M1(Human)
National Institute of Neurological Disorders and Stroke

Curated by PDSP Ki Database
LigandPNGBDBM81898(NSC_2054314 | (R)-Hexbutinol | NSC_2054312 | CAS_2...)
Affinity DataKi:  26.3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/18/2011
Entry Details
PubMed
TargetMuscarinic acetylcholine receptor M3(Human)
National Institute of Neurological Disorders and Stroke

Curated by PDSP Ki Database
LigandPNGBDBM81898(NSC_2054314 | (R)-Hexbutinol | NSC_2054312 | CAS_2...)
Affinity DataKi:  45.7nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/18/2011
Entry Details
PubMed
TargetMuscarinic acetylcholine receptor M2(Human)
National Institute of Neurological Disorders and Stroke

Curated by PDSP Ki Database
LigandPNGBDBM81898(NSC_2054314 | (R)-Hexbutinol | NSC_2054312 | CAS_2...)
Affinity DataKi:  72.4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/18/2011
Entry Details
PubMed
TargetMuscarinic acetylcholine receptor M5(Human)
National Institute of Neurological Disorders and Stroke

Curated by PDSP Ki Database
LigandPNGBDBM81898(NSC_2054314 | (R)-Hexbutinol | NSC_2054312 | CAS_2...)
Affinity DataKi:  75.9nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/18/2011
Entry Details
PubMed