In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2009 | 28 | 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) | 3.12 | 9.08 | -45.48 | 0 | 6 | -1 | 87 | 376.388 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 7.95 | -18.37 | 1 | 6 | 0 | 84 | 377.396 | 5 | ↓ |