In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2010 | 23 | No |
None
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) | 0.16 | 5.55 | -48.96 | 2 | 6 | 1 | 57 | 341.501 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.16 | 3.17 | -16.71 | 1 | 6 | 0 | 56 | 340.493 | 5 | ↓ |