| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 8th, 2006 | 35 | No |
Popular Name: LS-192629 LS-192629
| 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) | 3.03 | 9.93 | -20.58 | 2 | 7 | 0 | 91 | 471.557 | 7 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| OXYR-1-E | Oxytocin Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 135 | 0.27 | Binding ≤ 10μM |
| V1AR-1-E | Vasopressin V1a Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 170 | 0.27 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| OXYR_RAT | P70536 | Oxytocin Receptor, Rat | 135 | 0.27 | Binding ≤ 1μM |
| OXYR_HUMAN | P30559 | Oxytocin Receptor, Human | 28 | 0.30 | Binding ≤ 1μM |
| V1AR_HUMAN | P37288 | Vasopressin V1a Receptor, Human | 170 | 0.27 | Binding ≤ 1μM |
| OXYR_RAT | P70536 | Oxytocin Receptor, Rat | 135 | 0.27 | Binding ≤ 10μM |
| OXYR_HUMAN | P30559 | Oxytocin Receptor, Human | 28 | 0.30 | Binding ≤ 10μM |
| V1AR_HUMAN | P37288 | Vasopressin V1a Receptor, Human | 170 | 0.27 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| G alpha (q) signalling events | |
| Vasopressin-like receptors |
