In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 28th, 2010 | 25 | 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) | 3.20 | 9.11 | -17.35 | 1 | 6 | 0 | 88 | 335.363 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.20 | 9.48 | -45.98 | 2 | 6 | 1 | 89 | 336.371 | 5 | ↓ |