In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2009 | 32 | 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) | 0.94 | 3.16 | -27.74 | 3 | 15 | 0 | 195 | 442.396 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.94 | 5.48 | -61.79 | 4 | 15 | 1 | 197 | 443.404 | 7 | ↓ |