In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 12 | No |
None
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) | 0.03 | 3.26 | -42.64 | 0 | 4 | -1 | 67 | 167.188 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.03 | 5.56 | -50.33 | 1 | 4 | 0 | 68 | 168.196 | 3 | ↓ |