In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 13th, 2007 | 33 | 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) | 5.41 | 0.22 | -14.73 | 0 | 6 | 0 | 76 | 453.523 | 3 | ↓ |
Lo Low (pH 4.5-6) | 5.41 | 0.33 | -33.62 | 1 | 6 | 1 | 77 | 454.531 | 3 | ↓ |