| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2005 | 37 | No |
Popular Name: L-368899 L-368899
| 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) | 1.47 | -9.88 | -61.78 | 4 | 9 | 1 | 131 | 555.787 | 9 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0532097A1; EP0533240A2; EP0533240A3; EP0533241A2; EP0533241A3; EP0533242A2; EP0533242A3; EP0708765A1; EP0755374A1; EP0755374B1; EP0783306A1; US5502165; US5599809; US5648352; US5686454; US5773575; WO1995002587A1; WO1996012476A1 | IBM Patent Data |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| OXYR-1-E | Oxytocin Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 4 | 0.32 | Binding ≤ 10μM |
| OXYR-1-E | Oxytocin Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 9 | 0.30 | Binding ≤ 10μM |
| V1AR-1-E | Vasopressin V1a Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 180 | 0.26 | Binding ≤ 10μM |
| V1AR-1-E | Vasopressin V1a Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 370 | 0.24 | Binding ≤ 10μM |
| V2R-1-E | Vasopressin V2 Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 200 | 0.25 | Binding ≤ 10μM |
| V2R-1-E | Vasopressin V2 Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 570 | 0.24 | Binding ≤ 10μM |
| OXYR-2-E | Oxytocin Receptor (cluster #2 Of 2), Eukaryotic | Eukaryotes | 8 | 0.31 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| OXYR_HUMAN | P30559 | Oxytocin Receptor, Human | 13 | 0.30 | Binding ≤ 1μM |
| OXYR_RAT | P70536 | Oxytocin Receptor, Rat | 3.6 | 0.32 | Binding ≤ 1μM |
| V1AR_RAT | P30560 | Vasopressin V1a Receptor, Rat | 110 | 0.26 | Binding ≤ 1μM |
| V1AR_HUMAN | P37288 | Vasopressin V1a Receptor, Human | 180 | 0.26 | Binding ≤ 1μM |
| V2R_HUMAN | P30518 | Vasopressin V2 Receptor, Human | 590 | 0.24 | Binding ≤ 1μM |
| V2R_RAT | Q00788 | Vasopressin V2 Receptor, Rat | 200 | 0.25 | Binding ≤ 1μM |
| OXYR_RAT | P70536 | Oxytocin Receptor, Rat | 3.6 | 0.32 | Binding ≤ 10μM |
| OXYR_HUMAN | P30559 | Oxytocin Receptor, Human | 13 | 0.30 | Binding ≤ 10μM |
| V1AR_HUMAN | P37288 | Vasopressin V1a Receptor, Human | 180 | 0.26 | Binding ≤ 10μM |
| V1AR_RAT | P30560 | Vasopressin V1a Receptor, Rat | 110 | 0.26 | Binding ≤ 10μM |
| V2R_RAT | Q00788 | Vasopressin V2 Receptor, Rat | 200 | 0.25 | Binding ≤ 10μM |
| V2R_HUMAN | P30518 | Vasopressin V2 Receptor, Human | 590 | 0.24 | Binding ≤ 10μM |
| OXYR_HUMAN | P30559 | Oxytocin Receptor, Human | 8 | 0.31 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| G alpha (q) signalling events | |
| G alpha (s) signalling events | |
| Vasopressin regulates renal water homeostasis via Aquaporins | |
| Vasopressin-like receptors |
