CHEMBL4848198


SMILES CC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(N)=O)[C@@H](C)O
InChIKey OBHVCHMUTITNOT-XFTXAWHPSA-N

Chemical properties

Hydrogen bond acceptors 23
Hydrogen bond donors 24
Rotatable bonds 50
Molecular weight (Da) 1564.7

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
FZD2 FZD2 Rat Frizzled F pIC50 5.68 5.68 5.68 ChEMBL
FZD1 FZD1 Rat Frizzled F pIC50 5.69 5.69 5.69 ChEMBL