| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 20 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[(3-isopropoxyphenyl)methyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[(3-isopro…
| 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) | 3.38 | 7.83 | -37.69 | 2 | 3 | 1 | 29 | 279.448 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.38 | 8.36 | -35.34 | 2 | 3 | 1 | 26 | 279.448 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.38 | 9.6 | -118.1 | 3 | 3 | 2 | 30 | 280.456 | 9 | ↓ |
