In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 1st, 2008 | 17 | No |
Popular Name: 5-amino-1-(1,3-benzoxazol-2-yl)-2,3-dihydro-1H-pyrazole-4-carbonitrile 5-amino-1-(1,3-benzoxazol-2-yl)-…
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CAS Numbers: 1033463-25-0 , N/A
5-Amino-1-(benzo[d]oxazol-2-yl)-2,3-dihydro-1H-pyrazole-4-carbonitrile
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) | 0.30 | 2.8 | -8.65 | 3 | 6 | 0 | 91 | 227.227 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | >300° | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.