| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 18 | No |
Popular Name: (5S)-4-hydroxy-5-(6-hydroxyhexyl)-5-methyl-3-propyl-thiophen-2-one (5S)-4-hydroxy-5-(6-hydroxyhexyl…
| 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) | 4.00 | 4.11 | -14.13 | 2 | 3 | 0 | 58 | 272.41 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.41 | 4.77 | -6.99 | 1 | 3 | 0 | 54 | 272.41 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
