In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 27 | 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) | 4.04 | 9.56 | -41.21 | 0 | 5 | -1 | 67 | 444.33 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.58 | 10.62 | -10.34 | 1 | 5 | 0 | 64 | 445.338 | 4 | ↓ |