| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2005 | 23 | Yes |
Popular Name: 5'-(N-Cyclopropyl)carboxamidoadenosine 5'-(N-Cyclopropyl)carboxamidoade…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 50908-62-8 , [50908-62-8]
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -0.75 | -0.58 | -16.18 | 5 | 10 | 0 | 148 | 320.309 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| AA1R-2-E | Adenosine A1 Receptor (cluster #2 Of 4), Eukaryotic | Eukaryotes | 63 | 0.44 | Binding ≤ 10μM |
| AA2AR-1-E | Adenosine A2a Receptor (cluster #1 Of 4), Eukaryotic | Eukaryotes | 8 | 0.49 | Binding ≤ 10μM |
| AA2BR-1-E | Adenosine A2b Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 6 | 0.50 | Binding ≤ 10μM |
| AA3R-2-E | Adenosine Receptor A3 (cluster #2 Of 6), Eukaryotic | Eukaryotes | 108 | 0.42 | Binding ≤ 10μM |
| OXGR1-1-E | G Protein-coupled Receptor 80 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 96 | 0.43 | Binding ≤ 10μM |
| AA2BR-1-E | Adenosine A2b Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 5300 | 0.32 | Functional ≤ 10μM |
| Z50597-2-O | Rattus Norvegicus (cluster #2 Of 5), Other | Other | 6 | 0.50 | Binding ≤ 10μM |
| Z50588-3-O | Canis Familiaris (cluster #3 Of 7), Other | Other | 94 | 0.43 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| AA1R_RAT | P25099 | Adenosine A1 Receptor, Rat | 10.5 | 0.49 | Binding ≤ 1μM |
| AA2AR_HUMAN | P29274 | Adenosine A2a Receptor, Human | 260 | 0.40 | Binding ≤ 1μM |
| AA2AR_CAVPO | P46616 | Adenosine A2a Receptor, Guinea Pig | 8 | 0.49 | Binding ≤ 1μM |
| AA2AR_RAT | P30543 | Adenosine A2a Receptor, Rat | 110 | 0.42 | Binding ≤ 1μM |
| AA2BR_HUMAN | P29275 | Adenosine A2b Receptor, Human | 260 | 0.40 | Binding ≤ 1μM |
| AA2BR_RAT | P29276 | Adenosine A2b Receptor, Rat | 110 | 0.42 | Binding ≤ 1μM |
| AA3R_RAT | P28647 | Adenosine A3 Receptor, Rat | 5.5 | 0.50 | Binding ≤ 1μM |
| AA3R_HUMAN | P33765 | Adenosine A3 Receptor, Human | 108 | 0.42 | Binding ≤ 1μM |
| OXGR1_RAT | Q6Y1R5 | G Protein-coupled Receptor 80, Rat | 96 | 0.43 | Binding ≤ 1μM |
| Z50597 | Z50597 | Rattus Norvegicus | 5.5 | 0.50 | Binding ≤ 1μM |
| AA1R_RAT | P25099 | Adenosine A1 Receptor, Rat | 10.5 | 0.49 | Binding ≤ 10μM |
| AA2AR_HUMAN | P29274 | Adenosine A2a Receptor, Human | 260 | 0.40 | Binding ≤ 10μM |
| AA2AR_CAVPO | P46616 | Adenosine A2a Receptor, Guinea Pig | 8 | 0.49 | Binding ≤ 10μM |
| AA2AR_RAT | P30543 | Adenosine A2a Receptor, Rat | 110 | 0.42 | Binding ≤ 10μM |
| AA2BR_RAT | P29276 | Adenosine A2b Receptor, Rat | 110 | 0.42 | Binding ≤ 10μM |
| AA2BR_HUMAN | P29275 | Adenosine A2b Receptor, Human | 260 | 0.40 | Binding ≤ 10μM |
| AA3R_RAT | P28647 | Adenosine A3 Receptor, Rat | 1600 | 0.35 | Binding ≤ 10μM |
| AA3R_HUMAN | P33765 | Adenosine A3 Receptor, Human | 108 | 0.42 | Binding ≤ 10μM |
| OXGR1_RAT | Q6Y1R5 | G Protein-coupled Receptor 80, Rat | 96 | 0.43 | Binding ≤ 10μM |
| Z50597 | Z50597 | Rattus Norvegicus | 5.5 | 0.50 | Binding ≤ 10μM |
| AA2BR_HUMAN | P29275 | Adenosine A2b Receptor, Human | 5300 | 0.32 | Functional ≤ 10μM |
| Z50588 | Z50588 | Canis Familiaris | 94 | 0.43 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| Adenosine P1 receptors | |
| Class A/1 (Rhodopsin-like receptors) | |
| G alpha (i) signalling events | |
| G alpha (s) signalling events | |
| NGF-independant TRKA activation |
