| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2011 | 12 | 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) | -0.44 | 1.68 | -39.17 | 0 | 6 | -1 | 59 | 167.196 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.44 | 1.61 | -5.31 | 1 | 6 | 0 | 61 | 168.204 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.44 | 4.11 | -48.2 | 2 | 6 | 1 | 62 | 169.212 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
