neomycin
SMILES | OC[C@H]1O[C@H]([C@@H]([C@@H]1O[C@H]1O[C@@H](CN)[C@H]([C@@H]([C@H]1N)O)O)O)O[C@@H]1[C@@H](O)[C@H](N)C[C@@H]([C@H]1O[C@H]1O[C@H](CN)[C@H]([C@@H]([C@H]1N)O)O)N |
InChIKey | PGBHMTALBVVCIT-VCIWKGPPSA-N |
Chemical properties
Hydrogen bond acceptors | 19 |
Hydrogen bond donors | 13 |
Rotatable bonds | 9 |
Molecular weight (Da) | 614.3 |
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 |
CaS | CASR | Rat | Calcium-sensing | C | pKd | 8.4 | 8.4 | 8.4 | Drug Central |
CaS | CASR | Rat | Calcium-sensing | C | pKd | 4.0 | 4.0 | 4.0 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |