| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 20 | Yes |
Popular Name: 4-[(3R)-3-(3-pyrrolidin-1-ylpropylamino)butyl]phenol 4-[(3R)-3-(3-pyrrolidin-1-ylprop…
| 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) | 2.97 | 7.75 | -112.16 | 4 | 3 | 2 | 41 | 278.44 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.97 | 6.6 | -37.64 | 3 | 3 | 1 | 37 | 277.432 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.97 | 5.23 | -45.55 | 3 | 3 | 1 | 40 | 277.432 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
