| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2010 | 16 | Yes |
Popular Name: (2S)-N1,N1,3-trimethyl-N2-[[(2S)-tetrahydropyran-2-yl]methyl]butane-1,2-diamine (2S)-N1,N1,3-trimethyl-N2-[[(2S)…
| 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) | 2.12 | 6.48 | -33.52 | 2 | 3 | 1 | 29 | 229.388 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.12 | 6.81 | -105.94 | 3 | 3 | 2 | 30 | 230.396 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.12 | 5.4 | -28.83 | 2 | 3 | 1 | 26 | 229.388 | 6 | ↓ |
