| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 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) | 3.70 | 15.71 | -58.44 | 2 | 6 | 1 | 61 | 369.452 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.70 | 15.19 | -25.15 | 1 | 6 | 0 | 60 | 368.444 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.70 | 16.18 | -79.41 | 3 | 6 | 2 | 63 | 370.46 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.