| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 1st, 2011 | 30 | Yes |
Popular Name: 2-(4-ethoxycarbonylpiperazin-1-yl)-5-[(4-methylbenzoyl)amino]pyridine-3-carboxylic 2-(4-ethoxycarbonylpiperazin-1-y…
| 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) | 2.49 | 9.57 | -64.37 | 1 | 9 | -1 | 115 | 411.438 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 10.05 | -64.36 | 2 | 9 | 0 | 116 | 412.446 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
