In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: N-[(2-cyanophenyl)methyl]-N-ethyl-2-piperazin-1-yl-acetamide N-[(2-cyanophenyl)methyl]-N-ethy…
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) | 0.47 | 6.17 | -47.18 | 2 | 5 | 1 | 64 | 287.387 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.47 | 4.81 | -11.06 | 1 | 5 | 0 | 59 | 286.379 | 5 | ↓ |