| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 1st, 2011 | 28 | Yes |
Popular Name: 2-(4-acetylpiperazin-1-yl)-5-[(3-methylbenzoyl)amino]pyridine-3-carboxylic 2-(4-acetylpiperazin-1-yl)-5-[(3…
| 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) | 1.38 | 8.74 | -66.49 | 1 | 8 | -1 | 106 | 381.412 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.38 | 9.21 | -65.39 | 2 | 8 | 0 | 107 | 382.42 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
