In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 34 | 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) | 1.54 | 8.62 | -24.52 | 1 | 9 | 0 | 101 | 484.578 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.36 | 7.54 | -54.27 | 0 | 9 | -1 | 107 | 483.57 | 7 | ↓ |