In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 26 | 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) | 0.82 | 0.34 | -48.39 | 6 | 7 | 1 | 116 | 411.972 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.82 | -0.91 | -12.75 | 5 | 7 | 0 | 111 | 410.964 | 6 | ↓ |