CHEMBL526677
SMILES | CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)C(C)(C)NC(=O)[C@@H](NC(=O)C(C)(C)N)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCNC(=O)c1ccccc1-c1c2ccc(=O)cc-2oc2cc(O)ccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |
InChIKey | OGWIJMCFVCUOPC-SSOJYVRDSA-N |
Chemical properties
Hydrogen bond acceptors | 25 |
Hydrogen bond donors | 25 |
Rotatable bonds | 59 |
Molecular weight (Da) | 1980.0 |
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 |
PTH1 | PTH1R | Human | Parathyroid hormone | B1 | pIC50 | 7.87 | 7.87 | 7.87 | ChEMBL |
PTH1 | PTH1R | Human | Parathyroid hormone | B1 | pEC50 | 8.14 | 8.59 | 9.04 | ChEMBL |