| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 28 | No |
| 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) | 3.00 | 9.32 | -47.55 | 2 | 5 | 1 | 54 | 400.465 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.00 | 7.09 | -10.93 | 1 | 5 | 0 | 53 | 399.457 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
