In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 29 | 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) | 3.15 | 5.97 | -56.24 | 2 | 5 | -1 | 98 | 405.555 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.15 | 4.85 | -13.97 | 3 | 5 | 0 | 95 | 406.563 | 4 | ↓ |