In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 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) | 5.39 | 12.58 | -63.57 | 0 | 7 | -1 | 92 | 468.57 | 13 | ↓ |
Mid Mid (pH 6-8) | 5.39 | 11.69 | -16.37 | 1 | 7 | 0 | 89 | 469.578 | 13 | ↓ |