In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 21 | Yes |
Popular Name: 6-(4-isobutylpiperazine-1-carbonyl)pyridine-2-carboxylic 6-(4-isobutylpiperazine-1-carbon…
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) | 0.86 | 8.03 | -54.52 | 1 | 6 | 0 | 78 | 291.351 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.86 | 6.01 | -45.97 | 0 | 6 | -1 | 77 | 290.343 | 4 | ↓ |