| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 20 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[1-(3-methylbut-2-enyl)-4-piperidyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[1-(3-meth…
| 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) | 3.31 | 9.44 | -85.32 | 3 | 3 | 2 | 21 | 283.504 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.31 | 8.26 | -110.15 | 3 | 3 | 2 | 24 | 283.504 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.31 | 7.47 | -32.51 | 2 | 3 | 1 | 20 | 282.496 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.31 | 6.69 | -31.94 | 2 | 3 | 1 | 23 | 282.496 | 8 | ↓ |
