In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2004 | 15 | Yes |
Popular Name: 5-(3,4-Dimethyl-phenyl)-1-methyl-1H-imidazol-2-ylamine 5-(3,4-Dimethyl-phenyl)-1-methyl…
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CAS Numbers: 842971-55-5 , [842971-55-5]
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) | 2.30 | 8.25 | -29.35 | 3 | 3 | 1 | 45 | 202.281 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.30 | 7.75 | -8.07 | 2 | 3 | 0 | 44 | 201.273 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |