| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 3rd, 2010 | 27 | Yes |
Popular Name: (4aS,12aR)-4a-(3-methoxyphenyl)-2-methyl-1,3,4,5,12,12a-hexahydropyrido[3,4-b]acridine (4aS,12aR)-4a-(3-methoxyphenyl)-…
| 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) | 4.78 | 11.06 | -53.5 | 1 | 3 | 1 | 27 | 359.493 | 2 | ↓ |
| Mid Mid (pH 6-8) | 4.78 | 11.44 | -89.51 | 2 | 3 | 2 | 28 | 360.501 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5441956 | IBM Patent Data |
