| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2011 | 20 | Yes |
Popular Name: (2S)-2-cyclopropyl-3-(4-hydroxypyrimidin-2-yl)sulfanyl-2-(propylamino)propanamide (2S)-2-cyclopropyl-3-(4-hydroxyp…
| 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) | 1.72 | -0.16 | -62.31 | 4 | 6 | 0 | 109 | 296.396 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | -1.23 | -48.4 | 3 | 6 | -1 | 104 | 295.388 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.26 | 1.92 | -51.85 | 5 | 6 | 1 | 105 | 297.404 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
