| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 15 | Yes |
Popular Name: (2S)-1-(methylamino)-3-[methyl-[[(2S)-tetrahydropyran-2-yl]methyl]amino]propan-2-ol (2S)-1-(methylamino)-3-[methyl-[…
| 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) | 0.36 | -0.21 | -39.01 | 3 | 4 | 1 | 49 | 217.333 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.36 | 0.32 | -33.29 | 2 | 4 | 0 | 52 | 216.325 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.36 | 0.75 | -33.8 | 3 | 4 | 1 | 46 | 217.333 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.36 | 2.72 | -43.15 | 3 | 4 | 1 | 53 | 217.333 | 6 | ↓ |
