In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 16 | 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) | 0.05 | -2.35 | -9.76 | 2 | 5 | 0 | 62 | 228.292 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.05 | -0.15 | -35.41 | 3 | 5 | 1 | 63 | 229.3 | 4 | ↓ |