In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2011 | 34 | 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) | 3.84 | 7.44 | -51.05 | 5 | 9 | 1 | 147 | 466.493 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.84 | 7.43 | -13.23 | 4 | 9 | 0 | 145 | 465.485 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.