In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2011 | 25 | Yes |
Popular Name: 2-[3-(4-cyano-1-piperidyl)propanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide 2-[3-(4-cyano-1-piperidyl)propan…
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) | 1.68 | 3.74 | -14.8 | 3 | 6 | 0 | 99 | 360.483 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.68 | 5.97 | -60.35 | 4 | 6 | 1 | 100 | 361.491 | 5 | ↓ |