In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 31 | 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) | 4.74 | 14.2 | -15.21 | 1 | 7 | 0 | 65 | 440.979 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.74 | 14.56 | -36.83 | 2 | 7 | 1 | 66 | 441.987 | 3 | ↓ |