| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 21 | Yes |
Popular Name: (2S)-1-(azepan-1-yl)-2-[(3-chloro-4-fluoro-phenyl)methylamino]propan-1-one (2S)-1-(azepan-1-yl)-2-[(3-chlor…
| 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) | 3.36 | 7.57 | -9.64 | 1 | 3 | 0 | 32 | 312.816 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.36 | 8.81 | -50.95 | 2 | 3 | 1 | 37 | 313.824 | 4 | ↓ |
