| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 20 | Yes |
Popular Name: (1S,2S)-N1-methyl-N1-(1-methyl-4-piperidyl)-1-(3-methyl-2-thienyl)butane-1,2-diamine (1S,2S)-N1-methyl-N1-(1-methyl-4…
| 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) | 2.36 | 6.16 | -89.47 | 4 | 3 | 2 | 35 | 297.512 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.36 | 5.85 | -36.14 | 3 | 3 | 1 | 34 | 296.504 | 5 | ↓ |
