| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2010 | 17 | No |
Popular Name: 2-[[(2S)-2-methylmorpholin-4-yl]methyl]-5-propyl-4H-1,2,4-triazole-3-thione 2-[[(2S)-2-methylmorpholin-4-yl]…
| 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) | 0.84 | 5.19 | -11.13 | 1 | 5 | 0 | 46 | 256.375 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.84 | 7.61 | -38.22 | 2 | 5 | 1 | 47 | 257.383 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
