In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 15 | 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) | 3.05 | 7.41 | -3.37 | 1 | 1 | 0 | 12 | 221.731 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 8.54 | -41.47 | 2 | 1 | 1 | 17 | 222.739 | 5 | ↓ |