| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2009 | 17 | Yes |
Popular Name: (1S)-N-ethyl-1-[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]ethanamine (1S)-N-ethyl-1-[3-fluoro-4-(1,2,…
| 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) | 1.53 | 8.32 | -48.22 | 2 | 4 | 1 | 47 | 235.286 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.53 | 7.22 | -6.22 | 1 | 4 | 0 | 43 | 234.278 | 4 | ↓ |
