In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 25th, 2008 | 16 | 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) | 0.91 | 5.04 | -35.7 | 2 | 3 | 1 | 29 | 218.324 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.91 | 5.51 | -80.92 | 3 | 3 | 2 | 31 | 219.332 | 3 | ↓ |