General Information of the Compound
| Compound ID |
CP0499507
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| Compound Name |
(4R)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-4-prop-1-en-2-ylcyclohexene-1-carboxamide
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| Structure |
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| Formula |
C18H23NO3
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| Molecular Weight |
301.386
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| Canonical SMILES |
COc1cc(CNC(=O)C2=CC[C@@H](CC2)C(C)=C)ccc1O
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| InChI |
InChI=1S/C18H23NO3/c1-12(2)14-5-7-15(8-6-14)18(21)19-11-13-4-9-16(20)17(10-13)22-3/h4,7,9-10,14,20H,1,5-6,8,11H2,2-3H3,(H,19,21)/t14-/m0/s1
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| InChIKey |
YJPBPTUTOHNSTA-AWEZNQCLSA-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