General Information of the Compound
| Compound ID |
CP0845543
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| Compound Name |
(S)-3-(1'-Methylcyclohexanecarbonyl)amino-caprolactam
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| Structure |
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| Formula |
C14H24N2O2
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| Molecular Weight |
252.358
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| Canonical SMILES |
CC1(C(=O)N[C@H]2CCCCNC2=O)CCCCC1
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| InChI |
InChI=1S/C14H24N2O2/c1-14(8-4-2-5-9-14)13(18)16-11-7-3-6-10-15-12(11)17/h11H,2-10H2,1H3,(H,15,17)(H,16,18)/t11-/m0/s1
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| InChIKey |
DCWQNCVQDSMMDI-NSHDSACASA-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