| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 16 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[[(2S)-tetrahydropyran-2-yl]methyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[[(2S)-tet…
| 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) | 2.09 | 5.59 | -32.79 | 2 | 3 | 1 | 26 | 229.388 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.09 | 3.99 | -1.64 | 1 | 3 | 0 | 24 | 228.38 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.09 | 5.16 | -30.78 | 2 | 3 | 1 | 29 | 229.388 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.09 | 6.91 | -107.69 | 3 | 3 | 2 | 30 | 230.396 | 7 | ↓ |
