In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 18 | 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) | 4.25 | 6.26 | -48.91 | 3 | 3 | 1 | 46 | 317.247 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.25 | 7.03 | -63.49 | 2 | 3 | 0 | 49 | 316.239 | 8 | ↓ |