In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 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) | 2.76 | 9.55 | -59.05 | 2 | 8 | 1 | 90 | 469.558 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.17 | 10.25 | -67.73 | 1 | 8 | 1 | 87 | 469.558 | 10 | ↓ |