PD 102807


SMILES CCOC(=O)c1c(C)[nH]c2c1c1CN3CCc4c(C3Oc1cc2)ccc(c4)OC
InChIKey VDDUJINYXKGZLV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 392.2

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
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 7.4 7.5 7.6 Guide to Pharmacology
α2B ADA2B Human Adrenoceptors A pKi 5.49 5.49 5.49 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.23 6.23 6.23 ChEMBL
H2 HRH2 Human Histamine A pKi 5.55 5.55 5.55 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 7.33 7.89 8.19 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.12 6.12 6.12 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 6.14 6.5 6.76 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 6.3 6.3 6.3 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 5.96 6.12 6.27 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 5.64 5.76 5.88 ChEMBL
κ OPRK Human Opioid A pKi 5.71 5.71 5.71 ChEMBL
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 5.67 5.67 5.67 ChEMBL
M5 ACM5 Human Acetylcholine (muscarinic) A pKi 5.47 5.61 5.74 ChEMBL
μ OPRM Human Opioid A pKi 5.95 5.95 5.95 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
FPR3 FPR3 Human Formylpeptide A pIC50 5.24 5.24 5.24 ChEMBL
GPR35 GPR35 Human Orphan A pIC50 5.39 5.39 5.39 ChEMBL
FFA4 FFAR4 Human Free fatty acid A pEC50 5.88 5.88 5.88 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pIC50 7.04 7.04 7.04 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pEC50 7.27 7.27 7.27 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pIC50 6.02 6.02 6.02 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pIC50 5.46 5.46 5.46 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pIC50 5.18 5.18 5.18 ChEMBL
M5 ACM5 Human Acetylcholine (muscarinic) A pIC50 5.13 5.13 5.13 ChEMBL