In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 6th, 2008 | 34 | 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) | 1.68 | 2.6 | -21.71 | 3 | 9 | 0 | 126 | 469.49 | 12 | ↓ |
Mid Mid (pH 6-8) | 1.09 | 3.27 | -30.32 | 2 | 9 | 0 | 123 | 469.49 | 12 | ↓ |