| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2004 | 25 | Yes |
None
| 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) | 4.31 | 9.18 | -9.11 | 1 | 7 | 0 | 94 | 396.259 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.31 | 8.82 | -42.35 | 0 | 7 | -1 | 92 | 395.251 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.31 | 8.8 | -10.5 | 1 | 7 | 0 | 94 | 396.259 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.