| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 26 | 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) | 4.14 | 9.65 | -43.51 | 2 | 4 | 1 | 43 | 422.318 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.14 | 7.77 | -10.71 | 1 | 4 | 0 | 42 | 421.31 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
