In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 34 | 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) | 3.86 | 11.49 | -64.19 | 1 | 6 | -1 | 90 | 454.502 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.86 | 10.6 | -17.16 | 2 | 6 | 0 | 87 | 455.51 | 8 | ↓ |