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Cat. No. 000S-0510Stock: Yes |
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Descriptors | Libraries | |||
Molecular weight | 351.33 | |||
H_acceptor | 1 | |||
H_donor | 0 | |||
B_rotN | 7 | |||
logP | 7.31 | |||
logD | 7.31 | |||
logSw | -6.04 | |||
PSA | 17.07 | |||
Percent SP3 | 63.2 | |||
Smile | C(c1ccc(C2CCC(CC2)CCCCC)cc1)(=O)CBr | |||
InChI | InChI=1S/C19H27BrO/c1-2-3-4-5-15-6-8-16(9-7-15)17-10-12-18(13-11-17)19(21)14-20/h10-13,15-16H,2-9,14H2,1H3 | |||
InChI Key | OUXJTLQHZAMAEV-UHFFFAOYSA-N |
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