In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2010 | 37 | 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) | 6.02 | 14.21 | -61.87 | 2 | 6 | 1 | 63 | 528.727 | 6 | ↓ |
Mid Mid (pH 6-8) | 6.02 | 12 | -16.74 | 1 | 6 | 0 | 61 | 527.719 | 6 | ↓ |