| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 18 | Yes |
Popular Name: 2-[4-[(S)-cyano-(isopropylamino)methyl]phenoxy]acetamide 2-[4-[(S)-cyano-(isopropylamino)…
| 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) | 0.93 | 2.31 | -16.73 | 3 | 5 | 0 | 88 | 247.298 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.93 | 3.43 | -54.14 | 4 | 5 | 1 | 93 | 248.306 | 6 | ↓ |
