| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 14 | No |
Popular Name: 5-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-1,3,4-thiadiazole-2-thiol 5-[(3S)-3-(dimethylamino)pyrroli…
| 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) | 1.42 | 5.45 | -67.88 | 1 | 4 | 0 | 33 | 230.362 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.42 | 3.05 | -42.51 | 0 | 4 | -1 | 32 | 229.354 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
