| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2011 | 21 | No |
Popular Name: 1-(2,3-dimethylphenyl)-4-[(3R)-thiomorpholin-3-yl]-1,3,5-triazin-2-one 1-(2,3-dimethylphenyl)-4-[(3R)-t…
| 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) | 1.54 | 7.91 | -32.18 | 2 | 5 | 1 | 61 | 303.411 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.54 | 7.22 | -48.72 | 2 | 5 | 1 | 61 | 303.411 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.54 | 6.79 | -13.6 | 1 | 5 | 0 | 60 | 302.403 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
