| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 18th, 2011 | 28 | No |
Popular Name: 1-[(1R,2R)-2-hydroxy-1-(hydroxycarbamoyl)propyl]-3-[2-[4-(2-phenylethynyl)phenyl]ethyl]urea 1-[(1R,2R)-2-hydroxy-1-(hydroxyc…
| 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) | 1.49 | 3.38 | -17.2 | 5 | 7 | 0 | 111 | 381.432 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.49 | 4.59 | -52.45 | 4 | 7 | -1 | 114 | 380.424 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
