In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2010 | 28 | 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) | 0.30 | 9.18 | -51.31 | 2 | 9 | -1 | 119 | 386.432 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.30 | 10.22 | -51.56 | 3 | 9 | 0 | 121 | 387.44 | 6 | ↓ |