In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 21 | Yes |
Popular Name: 2-[4-(6-amino-3-pyridyl)piperazin-1-yl]-N-[(1S)-1-methylpropyl]acetamide 2-[4-(6-amino-3-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) | 1.50 | 2.97 | -33.19 | 4 | 6 | 1 | 76 | 292.407 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.50 | 2.51 | -10.25 | 3 | 6 | 0 | 74 | 291.399 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.