| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 14 | 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) | -0.36 | 1.44 | -44.64 | 3 | 6 | 1 | 80 | 192.202 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.36 | -0.26 | -10.74 | 2 | 6 | 0 | 76 | 191.194 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.36 | 2.17 | -103.18 | 4 | 6 | 2 | 82 | 193.21 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
