In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2008 | 23 | No |
None
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) | 1.31 | 0.32 | -21.25 | 3 | 9 | 0 | 152 | 357.369 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.31 | 0.41 | -52.94 | 2 | 9 | -1 | 154 | 356.361 | 5 | ↓ |