In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 27th, 2006 | 19 | 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) | -2.11 | -5.75 | -16.59 | 6 | 9 | 0 | 158 | 267.245 | 3 | ↓ |
Hi High (pH 8-9.5) | -1.65 | -7.89 | -48.38 | 5 | 9 | -1 | 161 | 266.237 | 3 | ↓ |