In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 19 | No |
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) | 2.41 | 8.2 | -19.42 | 2 | 3 | 0 | 44 | 273.405 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 8.61 | -33.94 | 3 | 3 | 1 | 45 | 274.413 | 3 | ↓ |