In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 30th, 2008 | 35 | 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) | 2.89 | 9.79 | -42.96 | 2 | 7 | 1 | 74 | 469.565 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.89 | 12.05 | -121.73 | 3 | 7 | 2 | 76 | 470.573 | 5 | ↓ |