| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 23rd, 2008 | 33 | No |
| 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) | -2.06 | -2 | -367.11 | 4 | 18 | -4 | 290 | 549.244 | 9 | ↓ |
| Mid Mid (pH 6-8) | -2.06 | -3.15 | -229.34 | 5 | 18 | -3 | 288 | 550.252 | 9 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| P2RY1-1-E | Purinergic Receptor P2Y1 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 8 | 0.34 | Binding ≤ 10μM |
| P2RX1-1-E | P2X Purinoceptor 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 54 | 0.31 | Functional ≤ 10μM |
| P2RX2-1-E | P2X Purinoceptor 2 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1500 | 0.25 | Functional ≤ 10μM |
| P2RX3-1-E | P2X Purinoceptor 3 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 350 | 0.27 | Functional ≤ 10μM |
| P2RX4-1-E | P2X Purinoceptor 4 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1000 | 0.25 | Functional ≤ 10μM |
| P2RX5-1-E | P2X Purinoceptor 5 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1000 | 0.25 | Functional ≤ 10μM |
| P2RX6-1-E | P2X Purinoceptor 6 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 600 | 0.26 | Functional ≤ 10μM |
| P2RY1-1-E | P2Y Purinoceptor 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1 | 0.38 | Functional ≤ 10μM |
| P2RY1-1-E | P2Y Purinoceptor 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 5 | 0.35 | Functional ≤ 10μM |
| P2RY1-1-E | P2Y Purinoceptor 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 8 | 0.34 | Functional ≤ 10μM |
| P2Y12-1-E | Purinergic Receptor P2Y12 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 1 | 0.38 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| P2RY1_HUMAN | P47900 | Purinergic Receptor P2Y1, Human | 34 | 0.32 | Binding ≤ 1μM |
| P2RY1_HUMAN | P47900 | Purinergic Receptor P2Y1, Human | 34 | 0.32 | Binding ≤ 10μM |
| P2RX1_HUMAN | P51575 | P2X Purinoceptor 1, Human | 54 | 0.31 | Functional ≤ 10μM |
| P2RX2_RAT | P49653 | P2X Purinoceptor 2, Rat | 1500 | 0.25 | Functional ≤ 10μM |
| P2RX3_HUMAN | P56373 | P2X Purinoceptor 3, Human | 350 | 0.27 | Functional ≤ 10μM |
| P2RX4_HUMAN | Q99571 | P2X Purinoceptor 4, Human | 1000 | 0.25 | Functional ≤ 10μM |
| P2RX4_RAT | P51577 | P2X Purinoceptor 4, Rat | 7400 | 0.22 | Functional ≤ 10μM |
| P2RX5_RAT | P51578 | P2X Purinoceptor 5, Rat | 1000 | 0.25 | Functional ≤ 10μM |
| P2RX6_RAT | P51579 | P2X Purinoceptor 6, Rat | 600 | 0.26 | Functional ≤ 10μM |
| P2RY1_HUMAN | P47900 | Purinergic Receptor P2Y1, Human | 8 | 0.34 | Functional ≤ 10μM |
| P2RY1_RAT | P49651 | Purinergic Receptor P2Y1, Rat | 4.5 | 0.35 | Functional ≤ 10μM |
| P2Y12_RAT | Q9EPX4 | Purinergic Receptor P2Y12, Rat | 1.1 | 0.38 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| ADP signalling through P2Y purinoceptor 1 | |
| ADP signalling through P2Y purinoceptor 12 | |
| Elevation of cytosolic Ca2+ levels | |
| G alpha (i) signalling events | |
| G alpha (q) signalling events | |
| P2Y receptors | |
| Platelet homeostasis |
