In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 20 | Yes |
Popular Name: 3-[(4-acetyl-1,4-diazepan-1-yl)methyl]-4-fluoro-benzonitrile 3-[(4-acetyl-1,4-diazepan-1-yl)m…
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) | 1.11 | 7.02 | -11.24 | 0 | 4 | 0 | 47 | 275.327 | 2 | ↓ |