In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 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) | 2.43 | 6.77 | -48.08 | 0 | 9 | -1 | 107 | 470.498 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.87 | 6.41 | -21.07 | 1 | 9 | 0 | 104 | 471.506 | 9 | ↓ |