In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2007 | 32 | 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) | 4.31 | -0.21 | -13.92 | 1 | 6 | 0 | 73 | 447.922 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.31 | -0.01 | -54.89 | 2 | 6 | 1 | 74 | 448.93 | 7 | ↓ |