| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 20 | Yes |
Popular Name: (3S)-1-(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)-N,N-dimethyl-pyrrolidin-3-amine (3S)-1-(4-chloro-6-imidazol-1-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) | 1.49 | 12.66 | -44.96 | 1 | 7 | 1 | 64 | 294.77 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.49 | 10.24 | -6.3 | 0 | 7 | 0 | 63 | 293.762 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.49 | 13.17 | -81.82 | 2 | 7 | 2 | 65 | 295.778 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
