| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 19 | Yes |
Popular Name: N-[(2S)-2-amino-2-phenyl-ethyl]-3-hydroxy-pyridine-2-carboxamide N-[(2S)-2-amino-2-phenyl-ethyl]-…
| 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) | -0.81 | 1.85 | -50.92 | 5 | 5 | 1 | 90 | 258.301 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.81 | 1.5 | -10.7 | 4 | 5 | 0 | 88 | 257.293 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.81 | 2.5 | -50.89 | 3 | 5 | -1 | 91 | 256.285 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.81 | 2.97 | -41.59 | 4 | 5 | 0 | 92 | 257.293 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.81 | 3.31 | -91.72 | 5 | 5 | 1 | 94 | 258.301 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
