| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 18 | 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) | 1.28 | 4.55 | -53.92 | 3 | 4 | 1 | 66 | 237.286 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.28 | 4.22 | -8.78 | 2 | 4 | 0 | 65 | 236.278 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.28 | 5.02 | -100.99 | 4 | 4 | 2 | 68 | 238.294 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
