In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2005 | 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) | 4.82 | -1.58 | -25.78 | 1 | 7 | 0 | 100 | 410.842 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.82 | -1.49 | -46.03 | 2 | 7 | 1 | 101 | 411.85 | 4 | ↓ |