| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 19 | Yes |
Popular Name: (1R)-1-[(3S)-1-ethyl-3-piperidyl]-N-[(5-methylpyrazin-2-yl)methyl]ethanamine (1R)-1-[(3S)-1-ethyl-3-piperidyl…
| 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) | 1.76 | 5.14 | -35.84 | 2 | 4 | 1 | 42 | 263.409 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 6.23 | -102.12 | 3 | 4 | 2 | 47 | 264.417 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
