CHEMBL4595467


SMILES CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)NCCN1CCN(CCCCC2CCN(CC(=O)N3c4ccccc4NC(=O)c4ccccc43)CC2)CC1
InChIKey DLMOQVWYEFDOHH-VUVDHCLXSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 6
Rotatable bonds 21
Molecular weight (Da) 872.5

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M5 ACM5 Human Acetylcholine (muscarinic) A pKi 6.62 6.62 6.62 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 6.82 6.82 6.82 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 9.45 9.45 9.45 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 8.53 8.53 8.53 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 8.45 8.45 8.45 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database