In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 37 | No |
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) | 6.25 | 14.17 | -61.5 | 0 | 6 | -1 | 73 | 518.033 | 10 | ↓ |
Lo Low (pH 4.5-6) | 6.25 | 13.42 | -14.13 | 1 | 6 | 0 | 70 | 519.041 | 10 | ↓ |