| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 24th, 2011 | 19 | Yes |
Popular Name: (3R)-3-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)-methyl-amino]butanenitrile (3R)-3-[(4-chloro-6-imidazol-1-y…
| 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) | 1.12 | 12.59 | -15.11 | 0 | 7 | 0 | 84 | 277.719 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.12 | 13.1 | -39.1 | 1 | 7 | 1 | 85 | 278.727 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
