| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 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) | 0.72 | 0 | -14.34 | 3 | 9 | 0 | 133 | 410.43 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.72 | 1.53 | -49.3 | 4 | 9 | 1 | 128 | 411.438 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
