| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 30th, 2010 | 19 | Yes |
Popular Name: 2-[4-[[2-[isopropyl(methyl)amino]ethylamino]methyl]phenoxy]acetonitrile 2-[4-[[2-[isopropyl(methyl)amino…
| 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) | 2.04 | 5.3 | -49.42 | 2 | 4 | 1 | 53 | 262.377 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.04 | 6.38 | -39.76 | 2 | 4 | 1 | 49 | 262.377 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.04 | 7.74 | -125.09 | 3 | 4 | 2 | 54 | 263.385 | 8 | ↓ |
