In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 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) | 0.50 | 9 | -26.15 | 1 | 10 | 0 | 117 | 461.478 | 8 | ↓ |
Lo Low (pH 4.5-6) | 0.50 | 9.46 | -48.4 | 2 | 10 | 1 | 119 | 462.486 | 8 | ↓ |