In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 18th, 2006 | 28 | 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) | 2.91 | -0.96 | -14.49 | 1 | 6 | 0 | 79 | 401.846 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.33 | -1.15 | -22.29 | 0 | 6 | 0 | 76 | 401.846 | 5 | ↓ |