In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2009 | 38 | 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) | -2.98 | 18.31 | -79.8 | 0 | 4 | 2 | 6 | 518.834 | 2 | ↓ |
Lo Low (pH 4.5-6) | -2.98 | 19.1 | -180.54 | 1 | 4 | 3 | 8 | 519.842 | 2 | ↓ |