| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2010 | 17 | Yes |
Popular Name: N-[[(3S)-1-[2-(1-piperidyl)ethyl]pyrrolidin-3-yl]methyl]ethanamine N-[[(3S)-1-[2-(1-piperidyl)ethyl…
| 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) | 1.59 | 5.99 | -80.93 | 3 | 3 | 2 | 24 | 241.423 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.59 | 3.76 | -37.37 | 2 | 3 | 1 | 23 | 240.415 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.59 | 6.24 | -100.19 | 3 | 3 | 2 | 24 | 241.423 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.59 | 8.45 | -188.59 | 4 | 3 | 3 | 25 | 242.431 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
