mitemcinal
SMILES | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@H]([C@]2(OC(=C(C)C2)[C@@H](C(=O)[C@]1(C)OC)C)C)O[C@@H]1O[C@H](C)C[C@@H]([C@H]1O)N(C(C)C)C |
InChIKey | BELMMAAWNYFCGF-AQBNEDITSA-N |
Chemical properties
Hydrogen bond acceptors | 13 |
Hydrogen bond donors | 2 |
Rotatable bonds | 9 |
Molecular weight (Da) | 755.5 |
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 |
motilin | MTLR | Human | Motilin | A | pIC50 | 8.4 | 8.4 | 8.4 | ChEMBL |
motilin | A5A4K8 | Rabbit | Motilin | A | pIC50 | 8.1 | 8.15 | 8.2 | Guide to Pharmacology |
motilin | A5A4K8 | Rabbit | Motilin | A | pEC50 | 7.5 | 7.65 | 7.8 | Guide to Pharmacology |