In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 34 | No |
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) | 6.58 | 12.32 | -42.44 | 2 | 6 | 1 | 73 | 487.016 | 9 | ↓ |
Mid Mid (pH 6-8) | 6.58 | 12.97 | -27.55 | 1 | 6 | 0 | 76 | 486.008 | 9 | ↓ |