In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | 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) | 1.62 | 7.46 | -104.58 | 4 | 4 | 2 | 52 | 271.449 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.62 | 5.66 | -48.55 | 3 | 4 | 1 | 51 | 270.441 | 8 | ↓ |