In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2009 | 33 | 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) | 4.44 | 10.65 | -10.49 | 0 | 6 | 0 | 63 | 466.965 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.44 | 12.98 | -46.15 | 1 | 6 | 1 | 64 | 467.973 | 5 | ↓ |