| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 24 | No |
| 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) | 1.71 | 5.53 | -23.59 | 2 | 7 | 0 | 97 | 334.372 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.17 | 4.52 | -59.1 | 1 | 7 | -1 | 101 | 333.364 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
