| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 18 | Yes |
Popular Name: N-[(1S)-1-(4-isopropoxyphenyl)ethyl]-N',N'-dimethyl-ethane-1,2-diamine N-[(1S)-1-(4-isopropoxyphenyl)et…
| 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) | 2.88 | 5.55 | -40.17 | 2 | 3 | 1 | 29 | 251.394 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.88 | 4.44 | -2.87 | 1 | 3 | 0 | 24 | 250.386 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.88 | 6.89 | -35.93 | 2 | 3 | 1 | 26 | 251.394 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.88 | 8.02 | -116.23 | 3 | 3 | 2 | 30 | 252.402 | 7 | ↓ |
