| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 21 | No |
Popular Name: (2R)-1-[[(3S)-1,1-dioxothian-3-yl]amino]-3-(4-nitropyrazol-1-yl)propan-2-ol (2R)-1-[[(3S)-1,1-dioxothian-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) | -0.80 | -0.06 | -73.77 | 3 | 9 | 1 | 135 | 319.363 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.80 | -1.25 | -22.45 | 2 | 9 | 0 | 130 | 318.355 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
