In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 18th, 2011 | 23 | Yes |
Popular Name: (2R)-N-(1-cyanocyclohexyl)-2-[(2-fluorophenyl)methyl-methyl-amino]propanamide (2R)-N-(1-cyanocyclohexyl)-2-[(2…
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) | 3.05 | 8.31 | -44.6 | 2 | 4 | 1 | 57 | 318.416 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 6.09 | -14.11 | 1 | 4 | 0 | 56 | 317.408 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.