In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 16 | 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) | 2.53 | 5.86 | -43.16 | 3 | 3 | 1 | 48 | 229.388 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.53 | 5.52 | -6.91 | 2 | 3 | 0 | 46 | 228.38 | 8 | ↓ |