General Information of the Compound
| Compound ID |
CP0413784
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| Compound Name |
(1S,2S)-N-[(1R)-2-hydroxy-1-[4-(2-methylpentoxy)phenyl]ethyl]-2-phenylcyclopropane-1-carboxamide
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| Structure |
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| Formula |
C24H31NO3
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| Molecular Weight |
381.516
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| Canonical SMILES |
CCCC(C)COc1ccc(cc1)[C@H](CO)NC(=O)[C@H]1C[C@@H]1c1ccccc1
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| InChI |
InChI=1S/C24H31NO3/c1-3-7-17(2)16-28-20-12-10-19(11-13-20)23(15-26)25-24(27)22-14-21(22)18-8-5-4-6-9-18/h4-6,8-13,17,21-23,26H,3,7,14-16H2,1-2H3,(H,25,27)/t17?,21-,22+,23+/m1/s1
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| InChIKey |
JRYLJLVWWQBUIH-KNFJIDDQSA-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