In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2008 | 27 | 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) | 2.90 | 8 | -57.06 | 0 | 6 | -1 | 83 | 433.278 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.90 | 7.25 | -11.85 | 1 | 6 | 0 | 80 | 434.286 | 7 | ↓ |