| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 16 | Yes |
Popular Name: 4-[(2-cyanoethyl-methyl-amino)methyl]-3-fluoro-benzonitrile 4-[(2-cyanoethyl-methyl-amino)me…
| 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) | 1.05 | 5.52 | -10.27 | 0 | 3 | 0 | 51 | 217.247 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.05 | 7.93 | -59.53 | 1 | 3 | 1 | 52 | 218.255 | 4 | ↓ |
