In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 34 | 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) | 3.71 | 10.87 | -50.17 | 2 | 8 | 1 | 77 | 461.542 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.71 | 11.23 | -108.58 | 3 | 8 | 2 | 79 | 462.55 | 6 | ↓ |