In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 16 | 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) | 4.92 | 6.48 | -2.54 | 3 | 2 | 0 | 38 | 240.778 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.92 | 6.65 | -30.01 | 4 | 2 | 1 | 43 | 241.786 | 6 | ↓ |