In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 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) | 2.58 | 6.44 | -44.65 | 2 | 3 | 1 | 34 | 305.225 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.58 | 4.17 | -8.91 | 1 | 3 | 0 | 33 | 304.217 | 5 | ↓ |