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Cat. No. 000S-0296Stock: Yes |
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Descriptors | Libraries | |||
Molecular weight | 187.201 | |||
H_acceptor | 2 | |||
H_donor | 2 | |||
B_rotN | 1 | |||
logP | 2.82 | |||
logD | 0.5 | |||
logSw | -0.49 | |||
PSA | 64.37 | |||
Percent SP3 | 0 | |||
Smile | c1ccc(c2[nH0]c([nH0+]([O-])cc2)N)cc1 | |||
InChI | InChI=1S/C10H9N3O/c11-10-12-9(6-7-13(10)14)8-4-2-1-3-5-8/h1-7H,(H2,11,12) | |||
InChI Key | YWRVUPYBXNCILR-UHFFFAOYSA-N |
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