General Information of the Compound
| Compound ID |
CP0119004
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| Compound Name |
1-cyclohexyl-2-(7-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)ethanol
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| Structure |
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| Formula |
C18H21FN2O
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| Molecular Weight |
300.377
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| Canonical SMILES |
OC(CC1c2cc(F)ccc2-c2cncn12)C1CCCCC1
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| InChI |
InChI=1S/C18H21FN2O/c19-13-6-7-14-15(8-13)16(21-11-20-10-17(14)21)9-18(22)12-4-2-1-3-5-12/h6-8,10-12,16,18,22H,1-5,9H2
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| InChIKey |
PKEXUVAGVPPMGW-UHFFFAOYSA-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