| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 20th, 2011 | 24 | No |
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) | -4.21 | 2.42 | -41.2 | 3 | 8 | 1 | 104 | 333.368 | 3 | ↓ |
| Mid Mid (pH 6-8) | -4.21 | 2.31 | -38.92 | 3 | 8 | 1 | 104 | 333.368 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.64 | 3.87 | -26.44 | 2 | 8 | 0 | 98 | 332.36 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
