| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 20 | Yes |
Popular Name: (3S)-N,N-diethyl-1-[2-(2-pyridylmethylamino)ethyl]pyrrolidin-3-amine (3S)-N,N-diethyl-1-[2-(2-pyridyl…
| 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) | 1.26 | 5.62 | -86.62 | 3 | 4 | 2 | 37 | 278.444 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.26 | 3.43 | -38.13 | 2 | 4 | 1 | 36 | 277.436 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.26 | 2.07 | -3.59 | 1 | 4 | 0 | 31 | 276.428 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
