| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 18 | No |
Popular Name: (2S)-2-amino-N-methyl-N-[(3-nitrophenyl)methyl]butanamide (2S)-2-amino-N-methyl-N-[(3-nitr…
| 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) | 0.74 | 5.1 | -47.25 | 3 | 6 | 1 | 94 | 252.294 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.74 | 4.8 | -7.93 | 2 | 6 | 0 | 92 | 251.286 | 5 | ↓ |
