In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 20 | Yes |
Popular Name: 4-[4-ethyl-5-oxo-3-[(3R)-3-piperidyl]-1,2,4-triazol-1-yl]butanamide 4-[4-ethyl-5-oxo-3-[(3R)-3-piper…
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) | -1.27 | 3.15 | -60.74 | 4 | 7 | 1 | 100 | 282.368 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.