In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2007 | 25 | Yes |
Popular Name: 2-[[2-(1-methylpyrrol-2-yl)azepan-1-yl]sulfonylmethyl]benzonitrile 2-[[2-(1-methylpyrrol-2-yl)azepa…
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) | 3.24 | -0.03 | -17.76 | 0 | 5 | 0 | 66 | 357.479 | 4 | ↓ |