In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2009 | 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) | -0.09 | -1.71 | -41.54 | 5 | 4 | 1 | 80 | 181.215 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.09 | -2.9 | -8.78 | 4 | 4 | 0 | 75 | 180.207 | 3 | ↓ |