In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 16th, 2006 | 14 | 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) | 3.52 | 7.6 | -36.43 | 2 | 1 | 1 | 17 | 210.366 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.52 | 6.4 | -2.2 | 1 | 1 | 0 | 12 | 209.358 | 3 | ↓ |