In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 19 | 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) | 3.88 | 6.77 | -3.15 | 0 | 2 | 0 | 12 | 328.225 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.88 | 8.88 | -34.39 | 1 | 2 | 1 | 14 | 329.233 | 2 | ↓ |