In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2011 | 24 | Yes |
Popular Name: N-[(3S)-1-[(1-ethyl-4-fluoro-benzimidazol-2-yl)methyl]-3-piperidyl]propanamide N-[(3S)-1-[(1-ethyl-4-fluoro-ben…
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) | 2.27 | 8.47 | -54.86 | 2 | 5 | 1 | 51 | 333.431 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 6.27 | -20.07 | 1 | 5 | 0 | 50 | 332.423 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.