| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2009 | 29 | No |
Popular Name: (4aS)-9-[3-(dimethylamino)propoxy]-2-(p-tolyl)-4,4a,5,6-tetrahydrobenzo[h]cinnolin-3-one (4aS)-9-[3-(dimethylamino)propox…
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) | 4.66 | 12.71 | -47.53 | 1 | 5 | 1 | 46 | 392.523 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.66 | 10.23 | -14.33 | 0 | 5 | 0 | 45 | 391.515 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5045541 | IBM Patent Data |
