nicotinic acid
SMILES | OC(=O)c1cccnc1 |
InChIKey | PVNIIMVLHYAWGP-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 1 |
Rotatable bonds | 1 |
Molecular weight (Da) | 123.0 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | Yes |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
HCA2 | HCAR2 | Human | Hydroxycarboxylic acid | A | pKd | 7.0 | 7.15 | 7.3 | Guide to Pharmacology |
HCA2 | HCAR2 | Rat | Hydroxycarboxylic acid | A | pKi | 7.48 | 7.48 | 7.48 | ChEMBL |
HCA2 | HCAR2 | Human | Hydroxycarboxylic acid | A | pKi | 6.98 | 7.12 | 7.3 | ChEMBL |
HCA2 | HCAR2 | Human | Hydroxycarboxylic acid | A | pKi | 8.14 | 8.14 | 8.14 | Drug Central |
HCA2 | HCAR2 | Rat | Hydroxycarboxylic acid | A | pKi | 8.13 | 8.13 | 8.13 | Drug Central |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
HCA2 | HCAR2 | Human | Hydroxycarboxylic acid | A | pEC50 | 6.0 | 6.6 | 7.2 | Guide to Pharmacology |
HCA3 | HCAR3 | Human | Hydroxycarboxylic acid | A | pEC50 | 4.0 | 5.26 | 6.52 | Guide to Pharmacology |
HCA2 | HCAR2 | Mouse | Hydroxycarboxylic acid | A | pEC50 | 6.57 | 7.22 | 7.54 | ChEMBL |
HCA2 | HCAR2 | Mouse | Hydroxycarboxylic acid | A | pIC50 | 6.85 | 6.85 | 6.85 | ChEMBL |
HCA2 | HCAR2 | Rat | Hydroxycarboxylic acid | A | pEC50 | 6.17 | 7.0 | 7.41 | ChEMBL |
HCA3 | HCAR3 | Human | Hydroxycarboxylic acid | A | pEC50 | 4.12 | 4.12 | 4.12 | ChEMBL |
HCA2 | HCAR2 | Human | Hydroxycarboxylic acid | A | pEC50 | 5.3 | 6.64 | 8.06 | ChEMBL |
HCA2 | HCAR2 | Human | Hydroxycarboxylic acid | A | pIC50 | 4.17 | 6.62 | 6.89 | ChEMBL |
HCA3 | HCAR3 | Human | Hydroxycarboxylic acid | A | pEC50 | 8.19 | 8.19 | 8.19 | Drug Central |
HCA2 | HCAR2 | Mouse | Hydroxycarboxylic acid | A | pIC50 | 8.16 | 8.16 | 8.16 | Drug Central |