In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 7th, 2007 | 35 | 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) | 4.87 | 12.36 | -43.91 | 0 | 8 | -1 | 119 | 492.439 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.87 | 11.63 | -13.13 | 1 | 8 | 0 | 116 | 493.447 | 5 | ↓ |