In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: N-allyl-2-[4-[2-(isopropylamino)acetyl]piperazin-1-yl]acetamide N-allyl-2-[4-[2-(isopropylamino)…
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) | 0.27 | 1.89 | -45.85 | 3 | 6 | 1 | 69 | 283.396 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.27 | 0.68 | -13.86 | 2 | 6 | 0 | 65 | 282.388 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.27 | 4.04 | -103.09 | 4 | 6 | 2 | 70 | 284.404 | 7 | ↓ |