| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 31 | 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) | 6.99 | 12.58 | -10.9 | 1 | 5 | 0 | 72 | 504.446 | 7 | ↓ |
| Mid Mid (pH 6-8) | 6.99 | 13.35 | -54.04 | 0 | 5 | -1 | 75 | 503.438 | 7 | ↓ |
| Mid Mid (pH 6-8) | 6.99 | 12.38 | -46.76 | 0 | 5 | -1 | 75 | 503.438 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
