MRS4183
SMILES | O=C(COc1ccc(cc1)C1=[N+]2C(=Cc3n([B-]2(F)F)c(cc3)c2cccs2)C=C1)NCCCCCNC(=O)[C@H]1O[C@H](OP(=O)(OP(=O)(OCC2OC(C(C2O)O)n2ccc(=O)[nH]c2=O)O)O)[C@@H]([C@H]([C@@H]1O)O)O |
InChIKey | DXQJLXWZLNCEJX-VBCGWZPHSA-N |
Chemical properties
Hydrogen bond acceptors | 20 |
Hydrogen bond donors | 10 |
Rotatable bonds | 20 |
Molecular weight (Da) | 1070.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/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 |
P2Y14 | P2Y14 | Human | P2Y | A | pEC50 | 9.02 | 9.02 | 9.02 | Guide to Pharmacology |