| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 21 | Yes |
Popular Name: (1R,2S)-N2-(2-dimethylaminoethyl)-N1-ethyl-1-phenyl-N2-propyl-propane-1,2-diamine (1R,2S)-N2-(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) | 3.32 | 8.92 | -86.03 | 3 | 3 | 2 | 24 | 293.499 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.32 | 6.39 | -30.77 | 2 | 3 | 1 | 20 | 292.491 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.32 | 6.45 | -35.32 | 2 | 3 | 1 | 23 | 292.491 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.32 | 7.1 | -35.62 | 2 | 3 | 1 | 20 | 292.491 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.32 | 8.88 | -106.24 | 3 | 3 | 2 | 21 | 293.499 | 10 | ↓ |
