| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 20 | Yes |
Popular Name: (2S)-2-amino-N-[(6-methyl-2-pyridyl)methyl]-2-phenyl-propanamide (2S)-2-amino-N-[(6-methyl-2-pyri…
| 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) | 1.14 | 3.78 | -8.9 | 3 | 4 | 0 | 68 | 269.348 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.14 | 4.08 | -48.72 | 4 | 4 | 1 | 70 | 270.356 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.14 | 4.46 | -105.31 | 5 | 4 | 2 | 71 | 271.364 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
