In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 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) | 1.82 | 8.01 | -53.02 | 0 | 10 | -1 | 115 | 480.497 | 9 | ↓ |
Lo Low (pH 4.5-6) | 1.82 | 6.87 | -24.91 | 1 | 10 | 0 | 112 | 481.505 | 9 | ↓ |