| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 28th, 2004 | 28 | 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) | 0.68 | 5.2 | -28.5 | 2 | 11 | 0 | 133 | 386.368 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.68 | 6.13 | -72.35 | 1 | 11 | -1 | 136 | 385.36 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 5.67 | -62.24 | 3 | 11 | 1 | 134 | 387.376 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
