In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2011 | 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) | 3.16 | 4.03 | -43.46 | 3 | 2 | 1 | 37 | 235.134 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.16 | 4.8 | -53.73 | 2 | 2 | 0 | 40 | 234.126 | 3 | ↓ |