In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 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) | 2.59 | 6.95 | -15.9 | 0 | 8 | 0 | 83 | 460.486 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.59 | 10.13 | -122.57 | 2 | 8 | 2 | 86 | 462.502 | 6 | ↓ |