In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 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) | 1.50 | 2.84 | -45.77 | 4 | 3 | 1 | 57 | 209.313 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.50 | 2.44 | -7.77 | 3 | 3 | 0 | 55 | 208.305 | 2 | ↓ |