| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 30 | Yes |
| 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) | 0.22 | 8.02 | -68.75 | 1 | 7 | -1 | 87 | 428.362 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.22 | 6.01 | -16.62 | 2 | 7 | 0 | 84 | 429.37 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.22 | 7.29 | -65.03 | 3 | 7 | 1 | 88 | 430.378 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
