In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 10th, 2004 | 28 | 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) | 4.68 | 11.01 | -12.89 | 1 | 5 | 0 | 56 | 371.44 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.68 | 11.36 | -29.25 | 2 | 5 | 1 | 58 | 372.448 | 6 | ↓ |