| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2009 | 21 | No |
Popular Name: (2S)-2-[4-(aminomethyl)-2-nitro-phenoxy]-N-[(1R)-1-methylpropyl]propanamide (2S)-2-[4-(aminomethyl)-2-nitro-…
| 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) | 1.74 | 5.75 | -74.35 | 4 | 7 | 1 | 112 | 296.347 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.74 | 5.35 | -22.4 | 3 | 7 | 0 | 110 | 295.339 | 7 | ↓ |
