In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2009 | 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) | 2.04 | 4.15 | -89.16 | 3 | 4 | 2 | 43 | 259.353 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.04 | 3.78 | -50.49 | 2 | 4 | 1 | 42 | 258.345 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.04 | 2.73 | -29.53 | 2 | 4 | 1 | 39 | 258.345 | 2 | ↓ |