In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 21 | Yes |
Popular Name: 2-[4-(5-amino-2-pyridyl)piperazin-1-yl]-N,N-diethyl-acetamide 2-[4-(5-amino-2-pyridyl)piperazi…
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) | 0.79 | 6.62 | -91.06 | 4 | 6 | 2 | 68 | 293.415 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.79 | 4.43 | -30.52 | 3 | 6 | 1 | 67 | 292.407 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.79 | 6.31 | -38.47 | 3 | 6 | 1 | 67 | 292.407 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.79 | 4.12 | -9.92 | 2 | 6 | 0 | 66 | 291.399 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.