| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2010 | 20 | No |
Popular Name: 3-[ethyl-[(5-morpholino-2-thioxo-1,3,4-thiadiazol-3-yl)methyl]amino]propanenitrile 3-[ethyl-[(5-morpholino-2-thioxo…
| 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) | 0.31 | 5.58 | -11.52 | 0 | 6 | 0 | 57 | 313.452 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.31 | 7.69 | -48.72 | 1 | 6 | 1 | 59 | 314.46 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
