In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 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) | 3.67 | 9.22 | -42.01 | 2 | 2 | 1 | 26 | 254.353 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.67 | 7.79 | -4.39 | 1 | 2 | 0 | 21 | 253.345 | 4 | ↓ |