In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2007 | 31 | 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) | 6.98 | 13.5 | -13.61 | 1 | 7 | 0 | 104 | 433.489 | 4 | ↓ |
Mid Mid (pH 6-8) | 6.49 | 13.62 | -44.72 | 0 | 7 | -1 | 103 | 432.481 | 5 | ↓ |