[125I]GR231118 [7675]
[125I]GR231118
| SMILES | CC[C@H](C)[C@H](N)C(O)=N[C@H]1CCC(O)=NC[C@@H](C(O)=N[C@@H](Cc2ccc(O)cc2)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc2ccc(O)cc2)C(=N)O)N=C(O)[C@@H]2CCCN2C(=O)[C@H](N=C(O)[C@@H](N)[C@@H](C)CC)CCC(O)=NC[C@H](C(O)=N[C@@H](Cc2ccc(O)cc2)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc2ccc(O)cc2)C(=N)O)N=C(O)[C@@H]2CCCN2C1=O |
| InChIKey | RJRBRCCJETZJLT-VHUVHYDGSA-N |
Chemical Properties
| Hydrogen bond acceptors | 30 |
| Hydrogen bond donors | 38 |
| Rotatable bonds | 58 |
| Log P | 8.763 |
| Molecular weight (Da) | 2351.3 |
| Stereochemistry info | partial |
| Radioactive | 125I |
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
[125I]GR231118
Drug properties
| Molecular type | Protein |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0