General Information of the Compound
| Compound ID |
CP0535864
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| Compound Name |
4-cyclohexylbutyl N-[(2S,3S)-1-(4-cyclohexylbutoxy)-2-methyl-4-oxoazetidin-3-yl]carbamate
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| Structure |
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| Formula |
C25H44N2O4
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| Molecular Weight |
436.637
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| Canonical SMILES |
C[C@H]1[C@H](NC(=O)OCCCCC2CCCCC2)C(=O)N1OCCCCC1CCCCC1
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| InChI |
InChI=1S/C25H44N2O4/c1-20-23(26-25(29)30-18-10-8-16-21-12-4-2-5-13-21)24(28)27(20)31-19-11-9-17-22-14-6-3-7-15-22/h20-23H,2-19H2,1H3,(H,26,29)/t20-,23-/m0/s1
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| InChIKey |
KFOHFVRGVYOREM-REWPJTCUSA-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