| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 16 | Yes |
Popular Name: 6-[[(1S)-1-(3-thienyl)ethyl]amino]-2H-1,2,4-triazine-3,5-dione 6-[[(1S)-1-(3-thienyl)ethyl]amin…
| 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) | 0.32 | 0.81 | -6.37 | 3 | 6 | 0 | 91 | 238.272 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | -0.86 | -36.57 | 2 | 6 | -1 | 94 | 237.264 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
