In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 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) | 0.52 | 2.91 | -51.7 | 3 | 3 | 1 | 48 | 195.217 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.52 | 2.59 | -8.51 | 2 | 3 | 0 | 46 | 194.209 | 1 | ↓ |