In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 38 | 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 | 12.38 | -20.36 | 0 | 7 | 0 | 62 | 519.686 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.25 | 14.69 | -57.83 | 1 | 7 | 1 | 64 | 520.694 | 9 | ↓ |