laropiprant
SMILES | OC(=O)C[C@H]1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F |
InChIKey | NXFFJDQHYLNEJK-CYBMUJFWSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 435.1 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | Yes |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
FP | PF2R | Human | Prostanoid | A | pKi | 5.0 | 5.0 | 5.0 | ChEMBL |
TP | TA2R | Human | Prostanoid | A | pKd | 7.96 | 7.96 | 7.96 | ChEMBL |
TP | TA2R | Human | Prostanoid | A | pKi | 8.53 | 8.53 | 8.53 | ChEMBL |
IP | PI2R | Human | Prostanoid | A | pKi | 5.18 | 5.18 | 5.18 | ChEMBL |
FP | PF2R | Human | Prostanoid | A | pKi | 8.3 | 8.3 | 8.3 | Drug Central |
IP | PI2R | Human | Prostanoid | A | pKi | 8.29 | 8.29 | 8.29 | Drug Central |
DP1 | PD2R | Human | Prostanoid | A | pKd | 7.98 | 7.98 | 7.98 | Drug Central |
DP1 | PD2R | Human | Prostanoid | A | pKd | 10.52 | 10.52 | 10.52 | ChEMBL |
DP1 | PD2R | Human | Prostanoid | A | pKi | 9.24 | 9.24 | 9.24 | ChEMBL |
DP2 | PD2R2 | Human | Prostanoid | A | pKi | 8.21 | 8.21 | 8.21 | Drug Central |
DP2 | PD2R2 | Human | Prostanoid | A | pKi | 6.13 | 6.13 | 6.13 | ChEMBL |
EP1 | PE2R1 | Human | Prostanoid | A | pKi | 8.23 | 8.23 | 8.23 | Drug Central |
EP1 | PE2R1 | Human | Prostanoid | A | pKi | 5.94 | 5.94 | 5.94 | ChEMBL |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 8.16 | 8.16 | 8.16 | Drug Central |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 6.87 | 6.87 | 6.87 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pKi | 8.22 | 8.22 | 8.22 | Drug Central |
EP3 | PE2R3 | Human | Prostanoid | A | pKi | 6.05 | 6.05 | 6.05 | ChEMBL |
TP | TA2R | Human | Prostanoid | A | pKi | 8.07 | 8.07 | 8.07 | Drug Central |
TP | TA2R | Human | Prostanoid | A | pKi | 6.1 | 6.1 | 6.1 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
TP | TA2R | Human | Prostanoid | A | pIC50 | 6.11 | 6.11 | 6.11 | ChEMBL |
DP1 | PD2R | Human | Prostanoid | A | pIC50 | 8.4 | 9.1 | 10.05 | ChEMBL |