In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 18th, 2011 | 15 | 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) | 0.36 | 0.82 | -44.58 | 4 | 5 | 0 | 97 | 211.217 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.36 | -0.24 | -50.24 | 3 | 5 | -1 | 96 | 210.209 | 4 | ↓ |