In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 34 | 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) | 4.27 | 12.54 | -66.72 | 1 | 6 | 0 | 74 | 466.553 | 12 | ↓ |
Lo Low (pH 4.5-6) | 4.27 | 11.71 | -45.18 | 2 | 6 | 1 | 71 | 467.561 | 12 | ↓ |