| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 20 | Yes |
Popular Name: (3S,4S)-N3-methyl-N4-propyl-N3-(4-pyridylmethyl)heptane-3,4-diamine (3S,4S)-N3-methyl-N4-propyl-N3-(…
| 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) | 3.41 | 8.72 | -42.49 | 2 | 3 | 1 | 33 | 278.464 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.41 | 9.07 | -39.59 | 2 | 3 | 1 | 29 | 278.464 | 10 | ↓ |
