| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 2nd, 2011 | 26 | Yes |
Popular Name: 2-[4-[[4-(methylcarbamoyl)phenyl]methyl]piperazin-1-yl]pyridine-3-carboxamide 2-[4-[[4-(methylcarbamoyl)phenyl…
| 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) | 0.40 | 3.1 | -17.64 | 3 | 7 | 0 | 92 | 353.426 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.40 | 5.32 | -47.44 | 4 | 7 | 1 | 93 | 354.434 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
