In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 18 | Yes |
None
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) | 3.29 | 7.71 | -51.02 | 3 | 2 | 1 | 51 | 237.326 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.29 | 7.49 | -6.18 | 2 | 2 | 0 | 50 | 236.318 | 3 | ↓ |