| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2010 | 19 | No |
Popular Name: (3S)-N-[(5-tert-butyl-2-methyl-1,2,4-triazol-3-yl)methyl]-1,1-dioxo-thiolan-3-amine (3S)-N-[(5-tert-butyl-2-methyl-1…
| 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 | 1.66 | -18.02 | 1 | 6 | 0 | 77 | 286.401 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.45 | 2.79 | -69.14 | 2 | 6 | 1 | 81 | 287.409 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
