In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2008 | 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) | 2.52 | 2.89 | -11.98 | 0 | 7 | 0 | 72 | 376.482 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 5.15 | -49.59 | 1 | 7 | 1 | 73 | 377.49 | 6 | ↓ |