4-OCTYLPHENOL


SMILES CCCCCCCCc1ccc(O)cc1
InChIKey NTDQQZYCCIDJRK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 206.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK2 NK2R Human Tachykinin A pKi 5.24 5.24 5.24 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 5.24 5.24 5.24 ChEMBL
M5 ACM5 Human Acetylcholine (muscarinic) A pKi 4.66 4.66 4.66 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 5.68 5.68 5.68 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 5.39 5.39 5.39 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 5.27 5.27 5.27 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 5.35 5.35 5.35 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 5.36 5.36 5.36 ChEMBL
A3 AA3R Human Adenosine A pKi 5.47 5.47 5.47 ChEMBL
A2A AA2AR Human Adenosine A pKi 4.9 4.9 4.9 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK2 NK2R Human Tachykinin A pIC50 4.76 4.76 4.76 ChEMBL
α2B ADA2B Human Adrenoceptors A pIC50 4.9 4.9 4.9 ChEMBL
M5 ACM5 Human Acetylcholine (muscarinic) A pIC50 4.51 4.51 4.51 ChEMBL
α2C ADA2C Human Adrenoceptors A pIC50 4.85 4.85 4.85 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pIC50 4.72 4.72 4.72 ChEMBL
α2A ADA2A Human Adrenoceptors A pIC50 4.84 4.84 4.84 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pIC50 4.9 4.9 4.9 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pIC50 4.74 4.74 4.74 ChEMBL
A3 AA3R Human Adenosine A pIC50 5.22 5.22 5.22 ChEMBL
A2A AA2AR Human Adenosine A pIC50 4.65 4.65 4.65 ChEMBL