In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 29th, 2007 | 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) | 1.64 | 5.82 | -52.59 | 0 | 7 | -1 | 86 | 426.88 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 8.17 | -69.24 | 1 | 7 | 0 | 87 | 427.888 | 6 | ↓ |