In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 4th, 2009 | 31 | 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) | 3.59 | 10.37 | -14.82 | 0 | 7 | 0 | 67 | 476.697 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.59 | 12.65 | -51.66 | 1 | 7 | 1 | 68 | 477.705 | 8 | ↓ |