VPC32183
SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)N[C@H](Cc1ccc(cc1)OCc1cccnc1)COP(=O)(O)O |
InChIKey | KMTDWYLEJRZIJN-HWNQJZBBSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 3 |
Rotatable bonds | 24 |
Molecular weight (Da) | 602.3 |
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 |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 7.6 | 7.6 | 7.6 | Guide to Pharmacology |
CB2 | CNR2 | Human | Cannabinoid | A | pKi | 7.64 | 7.64 | 7.64 | ChEMBL |
CB1 | CNR1 | Human | Cannabinoid | A | pKi | 5.0 | 5.0 | 5.0 | ChEMBL |
CB2 | CNR2 | Rat | Cannabinoid | A | pKi | 7.64 | 7.64 | 7.64 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CB2 | CNR2 | Human | Cannabinoid | A | pEC50 | 7.19 | 7.19 | 7.19 | ChEMBL |