In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 17 | 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) | 2.83 | 3.53 | -44.66 | 3 | 3 | 1 | 50 | 298.135 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.83 | 3.11 | -6.37 | 2 | 3 | 0 | 48 | 297.127 | 3 | ↓ |