General Information of the Compound
| Compound ID |
CP0717937
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| Compound Name |
(R)-3-(4-(4-fluorophenyl)-1H-imidazol-2-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
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| Structure |
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| Formula |
C20H17FN4
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| Molecular Weight |
332.382
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| Canonical SMILES |
Fc1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)CN3)n2)cc1
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| InChI |
InChI=1S/C20H17FN4/c21-13-7-5-12(6-8-13)18-10-23-20(25-18)17-9-15-14-3-1-2-4-16(14)24-19(15)11-22-17/h1-8,10,17,22,24H,9,11H2,(H,23,25)/t17-/m1/s1
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| InChIKey |
BMHAOFYWKWENPC-QGZVFWFLSA-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