In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2008 | 31 | No |
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) | 1.31 | 2.7 | -104.19 | 1 | 10 | -2 | 154 | 444.783 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.31 | 3.48 | -160.25 | 0 | 10 | -3 | 157 | 443.775 | 6 | ↓ |