In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 13 | 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) | 0.25 | 2.73 | -50.53 | 3 | 4 | 1 | 71 | 184.263 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.25 | 0.93 | -10.49 | 2 | 4 | 0 | 70 | 183.255 | 6 | ↓ |