General Information of the Compound
| Compound ID |
CP0935451
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| Compound Name |
(+/-)-(4-fluoro-N-(-6-hydroxy-7-(4-phenylpiperidin-1-yl)-5,6,7,8-tetrahydronaphthalen-1-yl)benzamide)
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| Structure |
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| Formula |
C28H29FN2O2
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| Molecular Weight |
444.55
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| Canonical SMILES |
O=C(Nc1cccc2c1C[C@@H](N1CCC(c3ccccc3)CC1)[C@H](O)C2)c1ccc(F)cc1
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| InChI |
InChI=1S/C28H29FN2O2/c29-23-11-9-21(10-12-23)28(33)30-25-8-4-7-22-17-27(32)26(18-24(22)25)31-15-13-20(14-16-31)19-5-2-1-3-6-19/h1-12,20,26-27,32H,13-18H2,(H,30,33)/t26-,27-/m1/s1
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| InChIKey |
PANIRRNNNUSKDC-KAYWLYCHSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound