| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 12 | Yes |
None
| 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) | 0.18 | 3.92 | -99.18 | 5 | 4 | 2 | 61 | 168.244 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.18 | 3.43 | -47.8 | 4 | 4 | 1 | 60 | 167.236 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.18 | 3.54 | -24.25 | 4 | 4 | 1 | 59 | 167.236 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.18 | 3.48 | -40.5 | 4 | 4 | 1 | 60 | 167.236 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
