| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 24 | No |
Popular Name: (3aS,7aR)-2-[(1S)-1-(4-pyrrol-1-ylphenyl)ethyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-quinone (3aS,7aR)-2-[(1S)-1-(4-pyrrol-1-…
| 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) | 3.22 | 11.58 | -9.68 | 0 | 4 | 0 | 42 | 322.408 | 3 | ↓ |
