In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 33 | 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) | 5.90 | 13.72 | -10.79 | 1 | 5 | 0 | 56 | 439.559 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.90 | 14.22 | -34.52 | 2 | 5 | 1 | 57 | 440.567 | 8 | ↓ |