| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 19 | 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) | 1.70 | 7.55 | -44.91 | 3 | 2 | 1 | 41 | 255.385 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.70 | 7.22 | -4.47 | 2 | 2 | 0 | 39 | 254.377 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.70 | 8.01 | -111.44 | 4 | 2 | 2 | 42 | 256.393 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
