| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 20 | Yes |
Popular Name: (2S)-2-amino-2-phenyl-N-[(1S)-1-(3-pyridyl)ethyl]propanamide (2S)-2-amino-2-phenyl-N-[(1S)-1-…
| 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) | 1.58 | 4.12 | -8.89 | 3 | 4 | 0 | 68 | 269.348 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.58 | 4.35 | -52.94 | 4 | 4 | 1 | 70 | 270.356 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.58 | 4.84 | -107.14 | 5 | 4 | 2 | 71 | 271.364 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
