In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2009 | 34 | Yes |
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) | 7.27 | 11.2 | -14.79 | 1 | 6 | 0 | 81 | 512.056 | 6 | ↓ |
Mid Mid (pH 6-8) | 7.27 | 11.23 | -48.94 | 0 | 6 | -1 | 83 | 511.048 | 6 | ↓ |