| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 3rd, 2011 | 26 | 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) | 0.62 | 6.04 | -44.95 | 1 | 7 | 1 | 58 | 369.53 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.62 | 3.64 | -11.54 | 0 | 7 | 0 | 56 | 368.522 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.62 | 7.88 | -85.27 | 2 | 7 | 2 | 59 | 370.538 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
