In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 37 | 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) | 2.73 | 12.07 | -54.98 | 0 | 10 | -1 | 122 | 518.575 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.73 | 10.76 | -23.84 | 1 | 10 | 0 | 119 | 519.583 | 8 | ↓ |