In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2006 | 14 | 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) | 3.77 | 6.5 | -8.54 | 1 | 2 | 0 | 37 | 192.258 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.77 | 7.51 | -54.53 | 0 | 2 | -1 | 40 | 191.25 | 4 | ↓ |