| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2010 | 30 | 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) | 3.43 | 10.88 | -43.49 | 0 | 5 | -1 | 86 | 439.944 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.18 | 11.63 | -32.04 | 1 | 5 | 0 | 79 | 440.952 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
