MRS2578
| SMILES | S=C=Nc1cccc(c1)NC(=S)NCCCCNC(=S)Nc1cccc(c1)N=C=S |
| InChIKey | QOHNRGHTJPFMSL-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 9 |
| Molecular weight (Da) | 472.1 |
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 |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| P2Y6 | P2RY6 | Human | P2Y | A | pIC50 | 4.4 | 6.82 | 7.43 | ChEMBL |
| P2Y6 | P2RY6 | Human | P2Y | A | pIC50 | 7.4 | 7.4 | 7.4 | Guide to Pharmacology |
| P2Y6 | P2RY6 | Rat | P2Y | A | pIC50 | 7.01 | 7.01 | 7.01 | ChEMBL |
| P2Y6 | P2RY6 | Rat | P2Y | A | pIC50 | 7.0 | 7.0 | 7.0 | Guide to Pharmacology |