In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 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) | 2.36 | 1.57 | -14.22 | 3 | 5 | 0 | 84 | 284.381 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.36 | 2.01 | -44.94 | 2 | 5 | -1 | 86 | 283.373 | 2 | ↓ |