In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 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) | 1.92 | 3.25 | -45.25 | 4 | 5 | 1 | 80 | 266.365 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.92 | 1.93 | -16.58 | 3 | 5 | 0 | 75 | 265.357 | 2 | ↓ |