In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 20 | Yes |
Popular Name: 3-[4-(3-carbamoyl-2-pyridyl)piperazin-1-yl]propanoic 3-[4-(3-carbamoyl-2-pyridyl)pipe…
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) | -0.68 | 4.79 | -45.54 | 3 | 7 | 0 | 104 | 278.312 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.68 | 2.55 | -54.69 | 2 | 7 | -1 | 103 | 277.304 | 5 | ↓ |