In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 22nd, 2009 | 28 | No |
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) | 2.39 | 6.91 | -71.11 | 1 | 6 | 1 | 68 | 401.508 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.39 | 4.76 | -20.75 | 0 | 6 | 0 | 67 | 400.5 | 4 | ↓ |