In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 29 | 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) | 2.23 | 5.96 | -53.25 | 2 | 7 | 1 | 68 | 417.555 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 3.71 | -11.97 | 1 | 7 | 0 | 67 | 416.547 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 5.97 | -50.79 | 2 | 7 | 1 | 68 | 417.555 | 7 | ↓ |