In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2010 | 22 | Yes |
Popular Name: N-allyl-2-[4-[(1S)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl]piperazin-1-yl]acetamide N-allyl-2-[4-[(1S)-1-methyl-2-ox…
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) | 0.57 | 1.89 | -12.44 | 1 | 6 | 0 | 56 | 308.426 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.57 | 3.99 | -35.14 | 2 | 6 | 1 | 57 | 309.434 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.