ENPROFYLLINE
SMILES | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 |
InChIKey | SIQPXVQCUCHWDI-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 2 |
Molecular weight (Da) | 194.1 |
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 |
A2A | AA2AR | Guinea pig | Adenosine | A | pKi | 4.04 | 4.04 | 4.04 | ChEMBL |
A1 | AA1R | Guinea pig | Adenosine | A | pKi | 4.22 | 4.22 | 4.22 | ChEMBL |
A3 | AA3R | Rat | Adenosine | A | pKi | 4.19 | 4.19 | 4.19 | ChEMBL |
A2A | AA2AR | Rat | Adenosine | A | pKi | 4.5 | 4.5 | 4.5 | ChEMBL |
A1 | AA1R | Rat | Adenosine | A | pKi | 4.09 | 4.28 | 4.5 | ChEMBL |
A2B | AA2BR | Human | Adenosine | A | pKi | 5.19 | 5.3 | 5.33 | ChEMBL |
A3 | AA3R | Human | Adenosine | A | pKi | 4.03 | 4.03 | 4.03 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 4.09 | 4.64 | 5.33 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 4.36 | 4.37 | 4.38 | ChEMBL |
A1 | AA1R | Rat | Adenosine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
A1 | AA1R | Bovine | Adenosine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
A1 | AA1R | Human | Adenosine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
A2A | AA2AR | Human | Adenosine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
A2B | AA2BR | Human | Adenosine | A | pKi | 5.19 | 5.19 | 5.2 | PDSP Ki database |
A3 | AA3R | Human | Adenosine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
A3 | AA3R | Rat | Adenosine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
A1 | AA1R | Human | Adenosine | A | pKi | 8.36 | 8.36 | 8.36 | Drug Central |
A2A | AA2AR | Human | Adenosine | A | pKi | 8.35 | 8.35 | 8.35 | Drug Central |
A2B | AA2BR | Human | Adenosine | A | pKi | 8.27 | 8.27 | 8.27 | Drug Central |
A3 | AA3R | Human | Adenosine | A | pKi | 8.39 | 8.39 | 8.39 | Drug Central |
A1 | AA1R | Guinea pig | Adenosine | A | pKi | 8.37 | 8.37 | 8.37 | Drug Central |
A3 | AA3R | Rat | Adenosine | A | pKi | 8.38 | 8.38 | 8.38 | Drug Central |
A2A | AA2AR | Guinea pig | Adenosine | A | pKi | 8.39 | 8.39 | 8.39 | Drug Central |
A2A | AA2AR | Rat | Adenosine | A | pKi | 8.35 | 8.35 | 8.35 | Drug Central |
A1 | AA1R | Rat | Adenosine | A | pKi | 8.35 | 8.35 | 8.35 | Drug Central |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
A2A | AA2AR | Human | Adenosine | A | pEC50 | 5.14 | 5.14 | 5.14 | ChEMBL |