| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 30th, 2011 | 18 | Yes |
Popular Name: (1R,3S)-3-methyl-1-(3-methyl-2-pyridyl)-N-propyl-hexan-1-amine (1R,3S)-3-methyl-1-(3-methyl-2-p…
| 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) | 4.63 | 8.78 | -32.44 | 2 | 2 | 1 | 29 | 249.422 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.63 | 7.58 | -4.15 | 1 | 2 | 0 | 25 | 248.414 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.63 | 8.38 | -25.65 | 2 | 2 | 1 | 26 | 249.422 | 8 | ↓ |
