| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 20 | No |
Popular Name: 2-[[1-[(3S)-1,1-dioxothiolan-3-yl]-3,5-dimethyl-pyrazol-4-yl]methylsulfanyl]acetic 2-[[1-[(3S)-1,1-dioxothiolan-3-y…
| 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) | 0.02 | 4.78 | -55.86 | 0 | 6 | -1 | 92 | 317.412 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.02 | 4.91 | -65.3 | 1 | 6 | 0 | 93 | 318.42 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
