In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 14th, 2009 | 13 | 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) | 2.41 | 8.04 | -32.48 | 1 | 1 | 1 | 4 | 176.283 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 5.77 | -2.48 | 0 | 1 | 0 | 3 | 175.275 | 1 | ↓ |