| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2011 | 19 | No |
Popular Name: 4-[[[(3S)-1,1-dioxothiolan-3-yl]amino]methyl]-N,N,2,5-tetramethyl-pyrazol-3-amine 4-[[[(3S)-1,1-dioxothiolan-3-yl]…
| 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) | -0.16 | 1.76 | -40.42 | 2 | 6 | 1 | 68 | 287.409 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.16 | 1.61 | -15.31 | 1 | 6 | 0 | 67 | 286.401 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.16 | 2.92 | -121.02 | 3 | 6 | 2 | 73 | 288.417 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
