| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 33 | 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) | 2.10 | 10.61 | -88.21 | 1 | 8 | 0 | 100 | 453.47 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.55 | 9.51 | -76.59 | 2 | 8 | 1 | 97 | 454.478 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.52 | 10.48 | -82.53 | 1 | 8 | 1 | 94 | 454.478 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
