General Information of the Compound
| Compound ID |
CP0466274
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| Compound Name |
(6-fluoro-3,3,9-trimethyl-4,5-dihydro-1H-pyrido[4,3-b]indol-2-yl)-[5-(trifluoromethyl)-1H-pyrazol-3-yl]methanone
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| Formula |
C19H18F4N4O
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| Molecular Weight |
394.372
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| Canonical SMILES |
Cc1ccc(F)c2[nH]c3CC(C)(C)N(Cc3c12)C(=O)c1cc([nH]n1)C(F)(F)F
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| InChI |
InChI=1S/C19H18F4N4O/c1-9-4-5-11(20)16-15(9)10-8-27(18(2,3)7-13(10)24-16)17(28)12-6-14(26-25-12)19(21,22)23/h4-6,24H,7-8H2,1-3H3,(H,25,26)
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| InChIKey |
DCGGPQSAHKYYPW-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