In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 18 | 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) | 4.20 | 8.12 | -6.89 | 2 | 3 | 0 | 44 | 263.772 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.20 | 8.16 | -26.74 | 3 | 3 | 1 | 45 | 264.78 | 4 | ↓ |