| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 20 | No |
Popular Name: 2-[2-[[(1R)-1-(3-nitrophenyl)butyl]amino]ethoxy]ethanol 2-[2-[[(1R)-1-(3-nitrophenyl)but…
| 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) | 1.41 | 5.12 | -52.64 | 3 | 6 | 1 | 92 | 283.348 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.41 | 3.94 | -10.31 | 2 | 6 | 0 | 87 | 282.34 | 10 | ↓ |
