In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2009 | 32 | 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) | 3.09 | 8.14 | -17.84 | 1 | 8 | 0 | 84 | 434.496 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.09 | 8.52 | -54.39 | 2 | 8 | 1 | 85 | 435.504 | 8 | ↓ |