| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 15 | 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) | -1.19 | -2.02 | -35.45 | 2 | 7 | -1 | 99 | 207.217 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.19 | -1.68 | -12.11 | 3 | 7 | 0 | 97 | 208.225 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -1.19 | -1.14 | -11.3 | 3 | 7 | 0 | 100 | 208.225 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
