| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2011 | 18 | 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) | 1.13 | 2.91 | -89.75 | 1 | 8 | -2 | 118 | 243.182 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.13 | 4.04 | -193.72 | 0 | 8 | -3 | 121 | 242.174 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.13 | 2.91 | -49.69 | 2 | 8 | -1 | 120 | 244.19 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
