In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 22nd, 2009 | 33 | 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) | 2.90 | 11.3 | -47.59 | 2 | 7 | 1 | 66 | 451.591 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 9.76 | -17.55 | 1 | 7 | 0 | 65 | 450.583 | 5 | ↓ |