| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 20 | Yes |
Popular Name: (3S)-1-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]sulfonylpiperidine-3-carboxylic (3S)-1-[(3R)-3-(dimethylamino)py…
| 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) | -0.11 | 4.38 | -67.27 | 1 | 7 | 0 | 85 | 305.4 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.11 | 1.97 | -48.67 | 0 | 7 | -1 | 84 | 304.392 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
