In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 16 | No |
Popular Name: 2-[Butyl(methyl)amino]-N'-hydroxybenzenecarboximidamide 2-[Butyl(methyl)amino]-N'-hydrox…
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CAS Numbers: 1021244-79-0 , N/A , [1021244-79-0]
2-(Butyl(methyl)amino)-N'-hydroxybenzimidamide
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) | 1.74 | 5.72 | -5.26 | 3 | 4 | 0 | 62 | 221.304 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.74 | 4.61 | -30.43 | 4 | 4 | 1 | 63 | 222.312 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.74 | 4.71 | -27.18 | 4 | 4 | 1 | 63 | 222.312 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |