In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 17 | 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) | 2.06 | 6.59 | -9.95 | 0 | 3 | 0 | 33 | 226.279 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.06 | 7.26 | -40.6 | 1 | 3 | 1 | 34 | 227.287 | 4 | ↓ |