In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2006 | 14 | No |
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) | 4.06 | 8.87 | -47.01 | 0 | 2 | -1 | 40 | 197.298 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.06 | 6.88 | -5.11 | 1 | 2 | 0 | 37 | 198.306 | 8 | ↓ |