In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 28th, 2009 | 18 | 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) | 3.83 | 5.95 | -8.53 | 1 | 3 | 0 | 41 | 249.354 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.83 | 6.72 | -56.23 | 0 | 3 | -1 | 43 | 248.346 | 4 | ↓ |