General Information of the Compound
| Compound ID |
CP0310404
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| Compound Name |
(S)-tetrahydrofuran-3-yl 4-((4-(4-fluoro-2-methylphenyl)piperidin-1-ylsulfonyl)methyl)-4-(hydroxycarbamoyl)piperidine-1-carboxylate
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| Structure |
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| Formula |
C24H34FN3O7S
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| Molecular Weight |
527.615
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| Canonical SMILES |
Cc1cc(F)ccc1C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)O[C@H]1CCOC1)C(=O)NO
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| InChI |
InChI=1S/C24H34FN3O7S/c1-17-14-19(25)2-3-21(17)18-4-9-28(10-5-18)36(32,33)16-24(22(29)26-31)7-11-27(12-8-24)23(30)35-20-6-13-34-15-20/h2-3,14,18,20,31H,4-13,15-16H2,1H3,(H,26,29)/t20-/m0/s1
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| InChIKey |
QVJFNCBRJKNUCE-FQEVSTJZSA-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