In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 25th, 2007 | 34 | 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) | 4.08 | 6.52 | -16.51 | 3 | 8 | 0 | 108 | 465.55 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.08 | 7.28 | -56.56 | 2 | 8 | -1 | 111 | 464.542 | 11 | ↓ |