In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2011 | 19 | No |
Popular Name: 3-isopentyl-5-[(4-nitroimidazol-1-yl)methyl]-1,2,4-oxadiazole 3-isopentyl-5-[(4-nitroimidazol-…
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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) | 1.60 | 7.6 | -19.21 | 0 | 8 | 0 | 103 | 265.273 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.60 | 8.07 | -50.51 | 1 | 8 | 1 | 104 | 266.281 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.