| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 21 | No |
Popular Name: 5-methyl-3-[[(3S)-3-(morpholinomethyl)-1-piperidyl]methyl]-1,3,4-thiadiazole-2-thione 5-methyl-3-[[(3S)-3-(morpholinom…
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| 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) | 0.77 | 4.11 | -9.87 | 0 | 5 | 0 | 34 | 328.507 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | 6.47 | -39.01 | 1 | 5 | 1 | 35 | 329.515 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | 6.15 | -46.21 | 1 | 5 | 1 | 35 | 329.515 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-[[3-(morpholinomethyl)piperidino]methyl]-1,3,4-thiadiazole-2-thione](http://zinc12.docking.org/img/rings/460732.gif)