In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 14th, 2006 | 23 | 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) | 3.16 | 10.95 | -44.36 | 1 | 5 | 1 | 44 | 353.899 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.16 | 8.47 | -12.99 | 0 | 5 | 0 | 43 | 352.891 | 8 | ↓ |