| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 17 | Yes |
Popular Name: (3S,4R)-N3-[(1S)-1,3-dimethylbutyl]-N3,N4-dimethyl-heptane-3,4-diamine (3S,4R)-N3-[(1S)-1,3-dimethylbut…
| 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) | 4.40 | 9.1 | -106.3 | 3 | 2 | 2 | 21 | 244.467 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.40 | 7.12 | -28.84 | 2 | 2 | 1 | 16 | 243.459 | 9 | ↓ |
