| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 11th, 2011 | 23 | Yes |
Popular Name: 5-[(3R)-1-(2-aminoacetyl)-3-piperidyl]-2-methyl-4-phenyl-1,2,4-triazol-3-one 5-[(3R)-1-(2-aminoacetyl)-3-pipe…
| 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) | -0.92 | 5.78 | -59.36 | 3 | 7 | 1 | 88 | 316.385 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.92 | 5.38 | -17.21 | 2 | 7 | 0 | 86 | 315.377 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
