In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 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) | 4.16 | 12.17 | -14.88 | 0 | 5 | 0 | 44 | 479.983 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.16 | 14.39 | -60.22 | 1 | 5 | 1 | 45 | 480.991 | 5 | ↓ |