In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 18 | 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) | 0.68 | 1.26 | -54.87 | 4 | 5 | 1 | 91 | 271.362 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.68 | 0.91 | -11.63 | 3 | 5 | 0 | 89 | 270.354 | 5 | ↓ |