In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 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) | 2.60 | 7.02 | -31.42 | 2 | 3 | 1 | 39 | 250.325 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.60 | 6.59 | -10.1 | 1 | 3 | 0 | 38 | 249.317 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.60 | 7.49 | -78.08 | 3 | 3 | 2 | 40 | 251.333 | 4 | ↓ |