In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 19 | Yes |
Popular Name: 2-[3-(1,4-diazepan-1-yl)phenoxy]-N,N-dimethyl-ethanamine 2-[3-(1,4-diazepan-1-yl)phenoxy]…
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) | 1.67 | 7.35 | -81.67 | 3 | 4 | 2 | 34 | 265.401 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.67 | 4.91 | -43.11 | 2 | 4 | 1 | 32 | 264.393 | 5 | ↓ |