In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2011 | 16 | 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) | 2.57 | 6.48 | -37.85 | 3 | 4 | 0 | 71 | 222.288 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.57 | 6.85 | -52.25 | 2 | 4 | -1 | 69 | 221.28 | 5 | ↓ |