| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 25th, 2008 | 29 | 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) | 1.55 | 8.16 | -42.16 | 2 | 10 | 1 | 110 | 409.442 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 8.04 | -43.9 | 2 | 10 | 1 | 110 | 409.442 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 5.7 | -9.44 | 1 | 10 | 0 | 108 | 408.434 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
