In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 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) | 1.41 | 2.71 | -18.27 | 3 | 13 | 0 | 159 | 441.452 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 5.04 | -51.31 | 4 | 13 | 1 | 160 | 442.46 | 8 | ↓ |