| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2008 | 16 | Yes |
Popular Name: (1S)-N-isopropyl-1-(3-methoxyphenyl)-N-methyl-ethane-1,2-diamine (1S)-N-isopropyl-1-(3-methoxyphe…
| 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) | 0.16 | 5.12 | -33.82 | 3 | 3 | 1 | 40 | 223.34 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.16 | 3.44 | -43.17 | 3 | 3 | 1 | 40 | 223.34 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.16 | 5.41 | -127.39 | 4 | 3 | 2 | 41 | 224.348 | 5 | ↓ |
