General Information of the Compound
| Compound ID |
CP0549055
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| Compound Name |
(1R,3S)-4-chloro-5-(4-fluorophenyl)-N-(3-hydroxycyclopentyl)isoxazole-3-carboxamide
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| Structure |
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| Formula |
C15H14ClFN2O3
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| Molecular Weight |
324.739
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| Canonical SMILES |
O[C@H]1CC[C@H](C1)NC(=O)c1noc(c1Cl)-c1ccc(F)cc1
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| InChI |
InChI=1S/C15H14ClFN2O3/c16-12-13(15(21)18-10-5-6-11(20)7-10)19-22-14(12)8-1-3-9(17)4-2-8/h1-4,10-11,20H,5-7H2,(H,18,21)/t10-,11+/m1/s1
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| InChIKey |
NPYDABASBGPJSZ-MNOVXSKESA-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