| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2009 | 30 | 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) | 3.96 | 8.13 | -134.7 | 0 | 9 | -2 | 143 | 427.438 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.96 | 7.1 | -49.72 | 1 | 9 | -1 | 140 | 428.446 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.96 | 6.82 | -15.29 | 2 | 9 | 0 | 138 | 429.454 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
