| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 20 | Yes |
Popular Name: (3S,4S)-N3,N4-diethyl-N3-(4-pyridylmethyl)heptane-3,4-diamine (3S,4S)-N3,N4-diethyl-N3-(4-pyri…
| 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) | 3.28 | 8.86 | -115.79 | 3 | 3 | 2 | 34 | 279.472 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.28 | 7.91 | -36.97 | 2 | 3 | 1 | 29 | 278.464 | 10 | ↓ |
