In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 26 | Yes |
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) | 3.25 | 10.48 | -39.45 | 1 | 4 | 1 | 28 | 358.55 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.25 | 10.05 | -38.66 | 1 | 4 | 1 | 28 | 358.55 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.