In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | Yes |
Popular Name: N-allyl-2-[4-[(2S)-2-aminobutanoyl]piperazin-1-yl]acetamide N-allyl-2-[4-[(2S)-2-aminobutano…
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) | -0.45 | -0.15 | -48.24 | 4 | 6 | 1 | 80 | 269.369 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.45 | -0.46 | -12.52 | 3 | 6 | 0 | 79 | 268.361 | 6 | ↓ |