| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 20 | No |
Popular Name: (2S)-1-(cyclohexoxy)-3-[[(3R)-1,1-dioxothian-3-yl]amino]propan-2-ol (2S)-1-(cyclohexoxy)-3-[[(3R)-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) | 1.13 | 1.14 | -57.57 | 3 | 5 | 1 | 80 | 306.448 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.13 | -0.09 | -13.01 | 2 | 5 | 0 | 76 | 305.44 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
