In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 31 | 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) | 4.10 | 8.6 | -12.83 | 1 | 6 | 0 | 59 | 489.458 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.10 | 11.04 | -48.32 | 2 | 6 | 1 | 61 | 490.466 | 6 | ↓ |