General Information of the Compound
| Compound ID |
CP0398392
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| Compound Name |
(1S,2S)-N-[(1R)-2-hydroxy-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-thiophen-2-ylcyclopropane-1-carboxamide
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| Structure |
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| Formula |
C20H25NO3S
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| Molecular Weight |
359.491
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| Canonical SMILES |
CC(C)COc1ccc(cc1)[C@H](CO)NC(=O)[C@H]1C[C@@H]1c1cccs1
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| InChI |
InChI=1S/C20H25NO3S/c1-13(2)12-24-15-7-5-14(6-8-15)18(11-22)21-20(23)17-10-16(17)19-4-3-9-25-19/h3-9,13,16-18,22H,10-12H2,1-2H3,(H,21,23)/t16-,17-,18-/m0/s1
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| InChIKey |
VXWCSZFDDQAUCH-BZSNNMDCSA-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