In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 31 | 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) | 5.28 | 9.58 | -46.97 | 1 | 6 | -1 | 87 | 434.541 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.82 | 10.68 | -13.48 | 2 | 6 | 0 | 84 | 435.549 | 6 | ↓ |