| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 21 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[(1R)-3-(4-methoxyphenyl)-1-methyl-propyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[(1R)-3-(4…
| 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) | 3.92 | 9.61 | -37.35 | 2 | 3 | 1 | 29 | 293.475 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.92 | 10.04 | -117.78 | 3 | 3 | 2 | 30 | 294.483 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.92 | 8.96 | -37.04 | 2 | 3 | 1 | 26 | 293.475 | 10 | ↓ |
