In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2010 | 33 | 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) | 1.24 | 2.66 | -64.07 | 2 | 9 | -1 | 129 | 454.455 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.24 | 1.92 | -20.84 | 3 | 9 | 0 | 126 | 455.463 | 8 | ↓ |