In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 25th, 2007 | 33 | 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) | 3.47 | 5.61 | -17.82 | 3 | 8 | 0 | 108 | 451.523 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.47 | 6.39 | -57.43 | 2 | 8 | -1 | 111 | 450.515 | 10 | ↓ |