HIMBACINE


SMILES CC1CCCC(N1C)C=CC2C3CCCCC3CC4C2C(OC4=O)C
InChIKey FMPNFDSPHNUFOS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 2
Molecular weight (Da) 345.3

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 6.66 6.92 7.28 PDSP Ki database
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 7.89 8.09 8.53 PDSP Ki database
M4 ACM4 Rat Acetylcholine (muscarinic) A pKi 7.3 7.69 8.22 PDSP Ki database
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 7.92 7.96 8.0 PDSP Ki database
M2 ACM2 Rat Acetylcholine (muscarinic) A pKi 7.82 8.0 8.34 PDSP Ki database
M5 ACM5 Rat Acetylcholine (muscarinic) A pKi 5.35 5.35 5.35 PDSP Ki database
M1 ACM1 Rat Acetylcholine (muscarinic) A pKi 6.68 6.95 7.16 PDSP Ki database
M3 ACM3 Rat Acetylcholine (muscarinic) A pKi 6.05 6.72 7.09 PDSP Ki database
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 6.85 6.96 7.03 PDSP Ki database
M5 ACM5 Human Acetylcholine (muscarinic) A pKi 5.35 5.83 6.31 PDSP Ki database
M4 ACM4 Chicken Acetylcholine (muscarinic) A pKi 8.2 8.2 8.2 PDSP Ki database
M4 ACM4 Mouse Acetylcholine (muscarinic) A pKi 7.22 7.22 7.22 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database