In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 33 | Yes |
None
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) | 1.59 | 9.77 | -18.08 | 2 | 8 | 0 | 96 | 440.507 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.59 | 9.79 | -18.21 | 2 | 8 | 0 | 96 | 440.507 | 6 | ↓ |