In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | 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) | 1.34 | 6.33 | -40.69 | 5 | 7 | 1 | 109 | 262.341 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.34 | 6.54 | -85.88 | 6 | 7 | 2 | 111 | 263.349 | 6 | ↓ |