In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 1st, 2006 | 25 | 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) | 4.42 | 9.33 | -10.9 | 1 | 5 | 0 | 48 | 359.857 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.42 | 9.72 | -29.08 | 2 | 5 | 1 | 49 | 360.865 | 5 | ↓ |