In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 19 | Yes |
Popular Name: (2S)-2-piperazin-1-yl-1-[(6S)-2,2,6-trimethylmorpholin-4-yl]propan-1-one (2S)-2-piperazin-1-yl-1-[(6S)-2,…
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) | 0.34 | 2.4 | -42.65 | 2 | 5 | 1 | 49 | 270.397 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.34 | 1.05 | -7.83 | 1 | 5 | 0 | 45 | 269.389 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.