General Information of the Compound
| Compound ID |
CP0428631
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| Compound Name |
2-(((1R,5S)-6-(phenoxymethyl)-3-aza-bicyclo[3.1.0]hexan-3-yl)methyl)H-imidazo[1,2-a]pyridine
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| Structure |
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| Formula |
C20H21N3O
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| Molecular Weight |
319.408
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| Canonical SMILES |
C(Oc1ccccc1)C1[C@@H]2CN(Cc3cn4ccccc4n3)C[C@H]12
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| InChI |
InChI=1S/C20H21N3O/c1-2-6-16(7-3-1)24-14-19-17-12-22(13-18(17)19)10-15-11-23-9-5-4-8-20(23)21-15/h1-9,11,17-19H,10,12-14H2/t17-,18+,19?
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| InChIKey |
PFIYEDTVQPPLAI-DFNIBXOVSA-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