In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | 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) | 0.50 | 5.3 | -55.25 | 0 | 6 | -1 | 77 | 279.316 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.50 | 7.52 | -80.59 | 1 | 6 | 0 | 78 | 280.324 | 6 | ↓ |