| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 13th, 2008 | 34 | 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) | 4.03 | 11.12 | -104.53 | 0 | 8 | -2 | 123 | 484.436 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.44 | 10.15 | -59.55 | 0 | 8 | -1 | 117 | 485.444 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.03 | 8.81 | -64.14 | 1 | 8 | -1 | 120 | 485.444 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
