| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 15 | Yes |
Popular Name: (3S,10bR)-3-methyl-2,3,4,10b-tetrahydro-1H-pyrazino[2,1-a]isoindol-6-one (3S,10bR)-3-methyl-2,3,4,10b-tet…
| 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) | 1.12 | 3.29 | -10.89 | 1 | 3 | 0 | 32 | 202.257 | 0 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 4.54 | -53.6 | 2 | 3 | 1 | 37 | 203.265 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4273773 | IBM Patent Data |
