In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2009 | 35 | 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) | 2.17 | 12.5 | -42.74 | 1 | 9 | -1 | 135 | 478.525 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.17 | 13.16 | -35.05 | 2 | 9 | 0 | 140 | 479.533 | 8 | ↓ |