| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 19 | Yes |
Popular Name: (1S)-1-(3-chloro-4-fluoro-phenyl)-N-[(1S)-1-(5-chloro-2-thienyl)ethyl]ethanamine (1S)-1-(3-chloro-4-fluoro-phenyl…
| 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) | 5.48 | 9.69 | -47.23 | 2 | 1 | 1 | 17 | 319.252 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.48 | 8.76 | -4.08 | 1 | 1 | 0 | 12 | 318.244 | 4 | ↓ |
