In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 31 | 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) | 0.87 | 5.5 | -14.91 | 0 | 8 | 0 | 72 | 431.533 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.87 | 7.79 | -50.74 | 1 | 8 | 1 | 73 | 432.541 | 8 | ↓ |