In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 14th, 2008 | 22 | Yes |
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) | 2.00 | 7.36 | -47.04 | 2 | 5 | 1 | 54 | 304.414 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.00 | 5.15 | -12.11 | 1 | 5 | 0 | 53 | 303.406 | 6 | ↓ |