In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 2nd, 2009 | 28 | Yes |
None
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) | 0.34 | 8.39 | -93.7 | 2 | 6 | 0 | 82 | 397.397 | 7 | ↓ |
Mid Mid (pH 6-8) | -2.40 | 7.43 | -70.08 | 3 | 6 | 1 | 85 | 398.405 | 6 | ↓ |