In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2010 | 14 | 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) | 1.51 | 5.22 | -6.08 | 0 | 3 | 0 | 25 | 212.68 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.51 | 5.54 | -31.5 | 1 | 3 | 1 | 27 | 213.688 | 2 | ↓ |