| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 15 | Yes |
Popular Name: (2R,3S)-N2,N3-dimethyl-N3-(4-pyridylmethyl)butane-2,3-diamine (2R,3S)-N2,N3-dimethyl-N3-(4-pyr…
| 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) | 0.90 | 5.49 | -112.4 | 3 | 3 | 2 | 34 | 209.337 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.90 | 3.61 | -40.07 | 2 | 3 | 1 | 33 | 208.329 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.90 | 4.46 | -37.21 | 2 | 3 | 1 | 29 | 208.329 | 5 | ↓ |
