In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 34 | 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) | 5.48 | 11.86 | -9.68 | 1 | 6 | 0 | 71 | 514.434 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.01 | 12.89 | -37.39 | 2 | 6 | 1 | 70 | 515.442 | 7 | ↓ |