| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 20 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[(1S)-2-(2-methoxyphenyl)-1-methyl-ethyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[(1S)-2-(2…
| 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) | 3.35 | 9.42 | -107.34 | 3 | 3 | 2 | 30 | 280.456 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.35 | 7.33 | -29.68 | 2 | 3 | 1 | 29 | 279.448 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.35 | 8.31 | -34.11 | 2 | 3 | 1 | 26 | 279.448 | 9 | ↓ |
