In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2006 | 28 | 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) | 1.35 | 5.58 | -17.36 | 0 | 7 | 0 | 88 | 399.472 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.35 | 5.87 | -35.5 | 1 | 7 | 1 | 89 | 400.48 | 4 | ↓ |