General Information of the Compound
| Compound ID |
CP0567192
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| Compound Name |
4-cyclohexylbutyl N-[(2S,3S)-2-methyl-1-(3-methylsulfonylphenoxy)-4-oxoazetidin-3-yl]carbamate
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| Structure |
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| Formula |
C22H32N2O6S
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| Molecular Weight |
452.573
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| Canonical SMILES |
C[C@H]1[C@H](NC(=O)OCCCCC2CCCCC2)C(=O)N1Oc1cccc(c1)S(C)(=O)=O
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| InChI |
InChI=1S/C22H32N2O6S/c1-16-20(23-22(26)29-14-7-6-11-17-9-4-3-5-10-17)21(25)24(16)30-18-12-8-13-19(15-18)31(2,27)28/h8,12-13,15-17,20H,3-7,9-11,14H2,1-2H3,(H,23,26)/t16-,20-/m0/s1
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| InChIKey |
IMSPPFSGDZGJCY-JXFKEZNVSA-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