In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2008 | 30 | Yes |
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) | 2.42 | 11.02 | -43.04 | 1 | 7 | 1 | 57 | 409.558 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.42 | 8.55 | -7.87 | 0 | 7 | 0 | 56 | 408.55 | 3 | ↓ |