| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 17 | No |
Popular Name: [(3S)-3-(diethylamino)pyrrolidin-1-yl]-[(4S)-thiazolidin-4-yl]methanone [(3S)-3-(diethylamino)pyrrolidin…
| 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) | 0.71 | 3.7 | -41.38 | 2 | 4 | 1 | 37 | 258.411 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.71 | 1.56 | -6.45 | 1 | 4 | 0 | 36 | 257.403 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.71 | 4.97 | -90.16 | 3 | 4 | 2 | 41 | 259.419 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
