| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 21 | Yes |
Popular Name: 6-[4-[(1S)-1-methylpropyl]piperazine-1-carbonyl]pyridine-3-carboxylic 6-[4-[(1S)-1-methylpropyl]pipera…
| 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) | 0.88 | 5.86 | -40.78 | 0 | 6 | -1 | 77 | 290.343 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.88 | 7.67 | -61.1 | 1 | 6 | 0 | 78 | 291.351 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
