General Information of the Compound
| Compound ID |
CP0788729
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| Compound Name |
2-(cycloheptanecarbonyl)-N-hydroxy-1,2,3,4-tetrahydroisoquinoline-6-carboxamide
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| Structure |
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| Formula |
C18H24N2O3
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| Molecular Weight |
316.401
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| Canonical SMILES |
O=C(NO)c1ccc2c(c1)CCN(C(=O)C1CCCCCC1)C2
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| InChI |
InChI=1S/C18H24N2O3/c21-17(19-23)15-7-8-16-12-20(10-9-14(16)11-15)18(22)13-5-3-1-2-4-6-13/h7-8,11,13,23H,1-6,9-10,12H2,(H,19,21)
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| InChIKey |
FCXSSUYDHIGTNN-UHFFFAOYSA-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