In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 1st, 2006 | 16 | No |
Popular Name: 2-(tert-Butylamino)-5-nitrobenzonitrile 2-(tert-Butylamino)-5-nitrobenzo…
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CAS Numbers: , 945299-05-8
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) | 2.62 | 2.4 | -7.81 | 1 | 5 | 0 | 81 | 219.244 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |