| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2009 | 21 | Yes |
| 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) | 1.17 | 9.55 | -51.95 | 1 | 6 | 0 | 74 | 286.335 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.17 | 7.32 | -48.24 | 0 | 6 | -1 | 72 | 285.327 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.17 | 10.02 | -84.15 | 2 | 6 | 1 | 75 | 287.343 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
