| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 20 | Yes |
Popular Name: (3R,4S)-N3-(2-dimethylaminoethyl)-N4-ethyl-N3-isobutyl-heptane-3,4-diamine (3R,4S)-N3-(2-dimethylaminoethyl…
| 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) | 3.95 | 8.81 | -94.36 | 3 | 3 | 2 | 24 | 287.536 | 12 | ↓ |
| Hi High (pH 8-9.5) | 3.95 | 6.63 | -36.08 | 2 | 3 | 1 | 23 | 286.528 | 12 | ↓ |
