In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 35 | 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) | 3.82 | 9.92 | -17.1 | 1 | 7 | 0 | 65 | 516.733 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.82 | 12.13 | -63.16 | 2 | 7 | 1 | 66 | 517.741 | 8 | ↓ |