In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 37 | 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) | 4.22 | 8.96 | -19.03 | 1 | 9 | 0 | 102 | 506.507 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.22 | 9.74 | -49.5 | 0 | 9 | -1 | 105 | 505.499 | 8 | ↓ |