In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 28th, 2008 | 24 | 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) | 1.45 | 4.98 | -48.47 | 0 | 6 | -1 | 80 | 322.344 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.99 | 7.64 | -9.09 | 1 | 6 | 0 | 77 | 323.352 | 2 | ↓ |