| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 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) | 1.24 | 4.36 | -12.3 | 1 | 5 | 0 | 56 | 245.282 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.24 | 4.54 | -36.68 | 2 | 5 | 1 | 58 | 246.29 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.24 | 4.53 | -39.13 | 2 | 5 | 1 | 58 | 246.29 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
