In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2006 | 24 | 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) | 2.75 | 7.98 | -15.14 | 1 | 4 | 0 | 55 | 316.36 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.75 | 8.26 | -48.52 | 2 | 4 | 1 | 56 | 317.368 | 4 | ↓ |