| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 19 | 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) | 2.10 | 7.17 | -43.6 | 2 | 4 | 1 | 54 | 267.393 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.10 | 6.61 | -7.18 | 1 | 4 | 0 | 49 | 266.385 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.10 | 6.55 | -4.94 | 1 | 4 | 0 | 49 | 266.385 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
