| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 18 | Yes |
Popular Name: (2R,4S)-N-(4-isopropylthiazol-2-yl)-4-methoxy-pyrrolidine-2-carboxamide (2R,4S)-N-(4-isopropylthiazol-2-…
| 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) | 1.32 | 2.78 | -42.95 | 3 | 5 | 1 | 68 | 270.378 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.51 | 1.13 | -36.71 | 2 | 5 | 0 | 74 | 269.37 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.32 | 1.39 | -7.11 | 2 | 5 | 0 | 63 | 269.37 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
