| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 28 | 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) | 1.48 | 6.09 | -21.86 | 3 | 9 | 0 | 112 | 389.456 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.48 | 6.4 | -51.95 | 4 | 9 | 1 | 113 | 390.464 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.48 | 6.35 | -43.67 | 4 | 9 | 1 | 113 | 390.464 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.