In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 6th, 2009 | 30 | 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) | 2.66 | 7.61 | -61.37 | 0 | 7 | -1 | 96 | 410.377 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.66 | 6.79 | -16.98 | 1 | 7 | 0 | 93 | 411.385 | 6 | ↓ |