| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 19 | Yes |
Popular Name: 1-[(5-chloro-1-methyl-imidazol-2-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzodiazepine 1-[(5-chloro-1-methyl-imidazol-2…
| 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) | 1.77 | 7.59 | -50.6 | 2 | 4 | 1 | 38 | 277.779 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.77 | 6.34 | -7.7 | 1 | 4 | 0 | 33 | 276.771 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.77 | 7.72 | -92.12 | 3 | 4 | 2 | 39 | 278.787 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
