| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 5th, 2010 | 19 | Yes |
Popular Name: (1S)-1-(3,4-dichlorophenyl)-N-[(1-ethylimidazol-2-yl)methyl]ethanamine (1S)-1-(3,4-dichlorophenyl)-N-[(…
| 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) | 3.28 | 8.76 | -33.79 | 2 | 3 | 1 | 31 | 299.225 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.28 | 8 | -9.1 | 1 | 3 | 0 | 30 | 298.217 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.28 | 9.58 | -120 | 3 | 3 | 2 | 36 | 300.233 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.28 | 9.11 | -49.39 | 2 | 3 | 1 | 34 | 299.225 | 5 | ↓ |
