| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2005 | 43 | No |
Popular Name: RGH-1106 RGH-1106
Find On: PubMed — Wikipedia — Google
CAS Numbers: 52212-02-9 , 68399-58-6
52212-02-9; Arduan (TN); D00764; Pipecuronium bromide (USAN/INN)
68399-58-6; C07554; Pipecuronium
None
| 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) | -3.66 | 6.46 | -91.94 | 0 | 8 | 2 | 59 | 602.905 | 6 | ↓ |
| Mid Mid (pH 6-8) | -3.66 | 8.93 | -176.45 | 1 | 8 | 3 | 60 | 603.913 | 6 | ↓ |
| Mid Mid (pH 6-8) | -3.66 | 6.76 | -184.85 | 1 | 8 | 3 | 60 | 603.913 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 9.50e-05 g/l | DrugBank-approved |
| PUBCHEM_PATENT_ID | EP0608495B1; EP0707853A1; EP0707853B1; US5446070; US5591735; US5719197; US5767112; US5795909; US5962536; US6025399; WO1996040086A2; WO1997044063A2; WO1999027914A1; WO1999030690A1; WO1999064032A1; WO1999064045A1; WO2000006142A1; WO2000044334A2; WO200005476 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.