| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 18 | Yes |
Popular Name: [(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-(4-amino-1H-pyrrol-2-yl)methanone [(4aR,8aR)-3,4,4a,5,6,7,8,8a-oct…
| 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) | 2.11 | 4.79 | -10.37 | 3 | 4 | 0 | 62 | 247.342 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.67 | 3.59 | -51.51 | 3 | 4 | 1 | 60 | 248.35 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
