| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 18 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-(1-prop-2-ynyl-4-piperidyl)propane-1,2-diamine (2S)-N1,N1-diethyl-N2-(1-prop-2-…
| 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) | 1.79 | 4.81 | -34.15 | 2 | 3 | 1 | 23 | 252.426 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.79 | 3.77 | -2.17 | 1 | 3 | 0 | 19 | 251.418 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 6.91 | -111.83 | 3 | 3 | 2 | 24 | 253.434 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 5.73 | -34.38 | 2 | 3 | 1 | 20 | 252.426 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.79 | 9.18 | -198.04 | 4 | 3 | 3 | 25 | 254.442 | 7 | ↓ |
