General Information of the Compound
| Compound ID |
CP0555910
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| Compound Name |
(6-fluoro-8-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-[5-(trifluoromethyl)-1H-pyrazol-3-yl]methanone
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| Formula |
C17H14F4N4O
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| Molecular Weight |
366.318
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| Canonical SMILES |
Cc1cc(F)c2[nH]c3CCN(Cc3c2c1)C(=O)c1cc([nH]n1)C(F)(F)F
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| InChI |
InChI=1S/C17H14F4N4O/c1-8-4-9-10-7-25(3-2-12(10)22-15(9)11(18)5-8)16(26)13-6-14(24-23-13)17(19,20)21/h4-6,22H,2-3,7H2,1H3,(H,23,24)
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| InChIKey |
CYILWGKYOXDMND-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