| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2011 | 19 | Yes |
Popular Name: (3R)-3-isopropyl-4-[(2-propylthiazol-4-yl)methyl]piperazin-2-one (3R)-3-isopropyl-4-[(2-propylthi…
| 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) | 1.78 | 3.52 | -8.22 | 1 | 4 | 0 | 45 | 281.425 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.78 | 5.41 | -39.67 | 2 | 4 | 1 | 46 | 282.433 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
