| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 21 | Yes |
Popular Name: (1R,2R)-N2-(2-dimethylaminoethyl)-N2-isobutyl-N1-methyl-1-phenyl-propane-1,2-diamine (1R,2R)-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) | 3.19 | 7.84 | -88.2 | 3 | 3 | 2 | 24 | 293.499 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.19 | 6.44 | -28.28 | 2 | 3 | 1 | 20 | 292.491 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.19 | 8.03 | -33.3 | 2 | 3 | 1 | 20 | 292.491 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.19 | 5.36 | -40.17 | 2 | 3 | 1 | 23 | 292.491 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.19 | 10.01 | -104.36 | 3 | 3 | 2 | 21 | 293.499 | 9 | ↓ |
