In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2011 | 21 | Yes |
Popular Name: 2-[1-[[methyl-[2-(methylamino)ethyl]carbamoyl]amino]cyclobutyl]-1H-imidazole-4-carboxylic 2-[1-[[methyl-[2-(methylamino)et…
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) | 0.56 | 3.63 | -87.86 | 4 | 8 | 0 | 118 | 295.343 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.56 | 2.19 | -73.38 | 3 | 8 | -1 | 113 | 294.335 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.56 | 4 | -72.27 | 5 | 8 | 1 | 119 | 296.351 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.