In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 26 | No |
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) | 3.70 | 10.6 | -10.11 | 1 | 5 | 0 | 57 | 386.908 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.23 | 9.55 | -44.1 | 0 | 5 | -1 | 59 | 385.9 | 6 | ↓ |