| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 15 | 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) | -0.29 | 2.79 | -10.25 | 1 | 5 | 0 | 56 | 203.249 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.29 | 4.16 | -54.17 | 2 | 5 | 1 | 60 | 204.257 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.29 | 3.31 | -36.29 | 2 | 5 | 1 | 57 | 204.257 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.29 | 4.67 | -107.34 | 3 | 5 | 2 | 61 | 205.265 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
