In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 29 | 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) | 3.56 | 11.77 | -17.38 | 0 | 6 | 0 | 69 | 428.945 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 12.64 | -37.07 | 1 | 6 | 1 | 71 | 429.953 | 6 | ↓ |