| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2011 | 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) | 0.88 | 3.36 | -36.12 | 2 | 3 | 1 | 33 | 206.313 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.88 | 2.1 | -4.1 | 1 | 3 | 0 | 28 | 205.305 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.88 | 3.42 | -82.74 | 3 | 3 | 2 | 34 | 207.321 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
