In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 12th, 2007 | 34 | 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) | 1.65 | 4.54 | -53.64 | 3 | 9 | 1 | 110 | 469.514 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.07 | -2.84 | -62.8 | 2 | 9 | 1 | 106 | 469.514 | 8 | ↓ |