In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 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) | 1.31 | 6.73 | -48.32 | 2 | 3 | 1 | 34 | 194.302 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.31 | 7.07 | -94.76 | 3 | 3 | 2 | 36 | 195.31 | 6 | ↓ |