| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2011 | 19 | Yes |
Popular Name: (2R)-2-(1,4-diazepan-1-yl)-2-(3-fluoro-4-methoxy-phenyl)ethanol (2R)-2-(1,4-diazepan-1-yl)-2-(3-…
| 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) | 1.01 | 2.13 | -36.23 | 3 | 4 | 1 | 46 | 269.34 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.01 | 1.51 | -42.39 | 3 | 4 | 1 | 49 | 269.34 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
