In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 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) | 3.86 | 9.82 | -53.98 | 1 | 4 | -1 | 77 | 385.524 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.86 | 7.84 | -16.12 | 2 | 4 | 0 | 75 | 386.532 | 4 | ↓ |