In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 36 | 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) | 5.66 | 14.36 | -17.17 | 1 | 6 | 0 | 69 | 484.644 | 13 | ↓ |
Mid Mid (pH 6-8) | 5.66 | 14.66 | -43.06 | 2 | 6 | 1 | 70 | 485.652 | 13 | ↓ |