In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 24 | 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) | 3.14 | 8.2 | -18.06 | 1 | 4 | 0 | 55 | 313.36 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.14 | 8.55 | -44.81 | 2 | 4 | 1 | 56 | 314.368 | 3 | ↓ |