In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 16 | 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) | 1.11 | -1.27 | -54.56 | 2 | 5 | -1 | 96 | 241.292 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.48 | 0.52 | -15.45 | 3 | 5 | 0 | 89 | 242.3 | 2 | ↓ |