In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 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) | -0.62 | 3.06 | -92.93 | 4 | 4 | 2 | 52 | 189.303 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.62 | 2.67 | -37.71 | 3 | 4 | 1 | 51 | 188.295 | 6 | ↓ |