In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2009 | 40 | 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) | 2.96 | 10.46 | -51.16 | 2 | 8 | 1 | 105 | 594.864 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.96 | 8.15 | -25.4 | 1 | 8 | 0 | 104 | 593.856 | 9 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
OXYR-1-E | Oxytocin Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 5 | 0.29 | Binding ≤ 10μM |
V1AR-1-E | Vasopressin V1a Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 530 | 0.22 | Binding ≤ 10μM |
V1BR-1-E | Vasopressin V1b Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 530 | 0.22 | Binding ≤ 10μM |
V2R-1-E | Vasopressin V2 Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1300 | 0.21 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
OXYR_RAT | P70536 | Oxytocin Receptor, Rat | 4.9 | 0.29 | Binding ≤ 1μM |
V1AR_RAT | P30560 | Vasopressin V1a Receptor, Rat | 530 | 0.22 | Binding ≤ 1μM |
V1BR_RAT | P48974 | Vasopressin V1b Receptor, Rat | 530 | 0.22 | Binding ≤ 1μM |
OXYR_RAT | P70536 | Oxytocin Receptor, Rat | 4.9 | 0.29 | Binding ≤ 10μM |
V1AR_RAT | P30560 | Vasopressin V1a Receptor, Rat | 530 | 0.22 | Binding ≤ 10μM |
V1BR_RAT | P48974 | Vasopressin V1b Receptor, Rat | 530 | 0.22 | Binding ≤ 10μM |
V2R_RAT | Q00788 | Vasopressin V2 Receptor, Rat | 1300 | 0.21 | Binding ≤ 10μM |
Description | Species |
---|---|
G alpha (q) signalling events | |
G alpha (s) signalling events | |
Vasopressin regulates renal water homeostasis via Aquaporins | |
Vasopressin-like receptors |