| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 17 | Yes |
Popular Name: N-[[(3S)-1-methyl-3-piperidyl]methyl]-1-(5-methylpyrazin-2-yl)methanamine N-[[(3S)-1-methyl-3-piperidyl]me…
| 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) | 1.05 | 3.96 | -36.88 | 2 | 4 | 1 | 42 | 235.355 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.05 | 5.33 | -102.88 | 3 | 4 | 2 | 47 | 236.363 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
