In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 37 | 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) | 5.04 | 14.24 | -11.77 | 0 | 5 | 0 | 46 | 514.588 | 12 | ↓ |
Mid Mid (pH 6-8) | 5.04 | 16.28 | -52.94 | 1 | 5 | 1 | 47 | 515.596 | 12 | ↓ |