| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 20 | No |
Popular Name: 3-[(2S)-2-methyl-1-piperidyl]-N-[[5-(methylsulfanylmethyl)-2-furyl]methyl]propan-1-amine 3-[(2S)-2-methyl-1-piperidyl]-N-…
| 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) | 3.03 | 9.87 | -107.49 | 3 | 3 | 2 | 34 | 298.496 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.03 | 8.5 | -34.5 | 2 | 3 | 1 | 30 | 297.488 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 7.76 | -42.84 | 2 | 3 | 1 | 33 | 297.488 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
