| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2011 | 18 | Yes |
Popular Name: (2S)-2-cyclopropyl-3-(4-hydroxypyrimidin-2-yl)sulfanyl-2-(methylamino)propanoic (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) | -1.09 | 3.82 | -36.47 | 3 | 6 | 0 | 102 | 269.326 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.63 | 0.5 | -95.98 | 1 | 6 | -2 | 101 | 267.31 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.09 | 2.01 | -62.43 | 2 | 6 | -1 | 98 | 268.318 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.63 | 1.74 | -64.59 | 2 | 6 | -1 | 106 | 268.318 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
