In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 24 | Yes |
Popular Name: N-[6-(4-isobutylpiperazin-1-yl)-3-pyridyl]thiophene-2-carboxamide N-[6-(4-isobutylpiperazin-1-yl)-…
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) | 3.11 | 9.3 | -41.41 | 2 | 5 | 1 | 50 | 345.492 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.11 | 7.34 | -8.92 | 1 | 5 | 0 | 48 | 344.484 | 5 | ↓ |