In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 2009 | 35 | No |
Popular Name: 2-(Bis(2-(2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethoxy)-2-oxoethyl)amino)acetic acid 2-(Bis(2-(2-(2-methyl-5-nitro-1H…
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CAS Numbers: 173357-17-0 , 298688-51-4 , [173357-17-0] , [298688-51-4]
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) | -1.90 | 12.39 | -62.14 | 0 | 17 | -1 | 223 | 496.413 | 16 | ↓ |
Lo Low (pH 4.5-6) | -1.90 | 14.31 | -52.91 | 1 | 17 | 0 | 224 | 497.421 | 16 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |