In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2009 | 21 | Yes |
None
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) | 1.05 | 6.04 | -46.92 | 2 | 5 | 1 | 54 | 288.371 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.05 | 3.85 | -13.29 | 1 | 5 | 0 | 53 | 287.363 | 5 | ↓ |