In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 8th, 2006 | 20 | 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) | 3.44 | 8.25 | -10.63 | 1 | 3 | 0 | 42 | 268.36 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.44 | 8.72 | -37.56 | 2 | 3 | 1 | 43 | 269.368 | 5 | ↓ |