| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 27 | 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) | 0.69 | 4.46 | -51.47 | 3 | 9 | 1 | 137 | 381.397 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.89 | 2.74 | -66.16 | 1 | 9 | -1 | 140 | 379.381 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.69 | 3.95 | -33.09 | 2 | 9 | 0 | 136 | 380.389 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
