In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 30 | 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) | 3.62 | 9.66 | -40 | 3 | 5 | 1 | 55 | 410.582 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.62 | 10.87 | -132.39 | 4 | 5 | 2 | 59 | 411.59 | 8 | ↓ |