In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2009 | 35 | 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) | 1.60 | 7.15 | -58.91 | 1 | 10 | -1 | 131 | 496.569 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.14 | 8.94 | -18.51 | 2 | 10 | 0 | 128 | 497.577 | 9 | ↓ |