In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2009 | 27 | Yes |
Popular Name: N-butyl-5-methyl-N-[3-oxo-3-[2-(1-piperidyl)ethylamino]propyl]pyrazine-2-carboxamide N-butyl-5-methyl-N-[3-oxo-3-[2-(…
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) | 1.88 | 8.51 | -49.48 | 2 | 7 | 1 | 80 | 376.525 | 10 | ↓ |
Hi High (pH 8-9.5) | 1.88 | 6.23 | -11.59 | 1 | 7 | 0 | 78 | 375.517 | 10 | ↓ |