| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 20 | Yes |
Popular Name: 3-[4-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperazin-1-yl]propan-1-amine 3-[4-(4,6-dimethoxy-1,3,5-triazi…
| 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) | 0.79 | 0.95 | -116.1 | 4 | 8 | 2 | 92 | 284.364 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.79 | -1.64 | -7.46 | 2 | 8 | 0 | 90 | 282.348 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.79 | 0.57 | -42.58 | 3 | 8 | 1 | 91 | 283.356 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.79 | -1.27 | -49.8 | 3 | 8 | 1 | 91 | 283.356 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
