In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2006 | 26 | Yes |
None
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) | 3.79 | 7.44 | -12.36 | 2 | 5 | 0 | 69 | 351.381 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.79 | 8.22 | -51.2 | 1 | 5 | -1 | 72 | 350.373 | 4 | ↓ |