In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2009 | 28 | 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) | 3.88 | 9.46 | -55.31 | 1 | 4 | -1 | 77 | 387.54 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.88 | 7.49 | -9.38 | 2 | 4 | 0 | 75 | 388.548 | 4 | ↓ |