In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2009 | 14 | 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) | 2.21 | 3.77 | -5.36 | 1 | 3 | 0 | 38 | 211.648 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.21 | 5.15 | -44.46 | 2 | 3 | 1 | 43 | 212.656 | 4 | ↓ |