| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2011 | 21 | No |
Popular Name: 3-[(3R)-1-[[5-(dimethylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]-3-piperidyl]propanamide 3-[(3R)-1-[[5-(dimethylamino)-2-…
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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) | 0.68 | 4.05 | -15.5 | 2 | 6 | 0 | 67 | 329.495 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 6.39 | -40.64 | 3 | 6 | 1 | 69 | 330.503 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
