In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 22 | 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) | 1.79 | 5.44 | -38.29 | 2 | 4 | 1 | 29 | 304.458 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.79 | 7.77 | -89.19 | 3 | 4 | 2 | 30 | 305.466 | 6 | ↓ |