In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2007 | 25 | 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) | 0.54 | -0.54 | -62.71 | 2 | 6 | -1 | 99 | 372.348 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.54 | -0.5 | -81.34 | 3 | 6 | 0 | 100 | 373.356 | 3 | ↓ |