In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 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) | 1.76 | 3.95 | -50.81 | 4 | 4 | 1 | 70 | 258.345 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.76 | 3.66 | -9.01 | 3 | 4 | 0 | 68 | 257.337 | 4 | ↓ |