In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 31 | 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) | 2.99 | 7.07 | -27.9 | 1 | 7 | 0 | 84 | 434.521 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.99 | 9.35 | -54.37 | 2 | 7 | 1 | 86 | 435.529 | 7 | ↓ |