In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 22 | 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) | 3.70 | 7.82 | -6.28 | 0 | 3 | 0 | 22 | 297.398 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.70 | 10.08 | -42.38 | 1 | 3 | 1 | 23 | 298.406 | 5 | ↓ |