In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 37 | Yes |
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) | 4.59 | 13.29 | -58.88 | 2 | 6 | 1 | 68 | 514.685 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.59 | 11.06 | -17.11 | 1 | 6 | 0 | 67 | 513.677 | 8 | ↓ |