In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2010 | 40 | No |
None
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) | 5.92 | 13.04 | -14.83 | 0 | 7 | 0 | 76 | 617.569 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.92 | 15.01 | -50.79 | 1 | 7 | 1 | 77 | 618.577 | 5 | ↓ |