In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2011 | 22 | Yes |
Popular Name: 1-cyano-N-[[3-[[ethyl(methyl)amino]methyl]phenyl]methyl]cyclopentanecarboxamide 1-cyano-N-[[3-[[ethyl(methyl)ami…
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) | 2.57 | 8.83 | -38.59 | 2 | 4 | 1 | 57 | 300.426 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.57 | 6.5 | -6.7 | 1 | 4 | 0 | 56 | 299.418 | 6 | ↓ |