In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 20 | Yes |
Popular Name: 3-(4-amino-1-piperidyl)-N-(2-cyanophenyl)propanamide 3-(4-amino-1-piperidyl)-N-(2-cya…
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) | 0.39 | 2.81 | -48.15 | 4 | 5 | 1 | 84 | 273.36 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.39 | 5.04 | -113.94 | 5 | 5 | 2 | 85 | 274.368 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.