In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 17 | 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) | -0.08 | 3.28 | -47.13 | 2 | 4 | 1 | 40 | 236.339 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.08 | 5.52 | -95.39 | 3 | 4 | 2 | 41 | 237.347 | 2 | ↓ |