In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 32 | Yes |
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) | 3.65 | 10.06 | -10.84 | 0 | 5 | 0 | 42 | 470.919 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.65 | 12.23 | -42.33 | 1 | 5 | 1 | 43 | 471.927 | 9 | ↓ |