General Information of the Compound
| Compound ID |
CP0523748
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| Compound Name |
11-methyl-2-(oxan-2-ylmethyl)-9-(trifluoromethyl)-1,3,4,4a,5,6,11,11a-octahydropyrido[4,3-b]carbazole
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| Structure |
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| Formula |
C23H29F3N2O
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| Molecular Weight |
406.492
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| Canonical SMILES |
CC1C2CN(CC3CCCCO3)CCC2Cc2[nH]c3ccc(cc3c12)C(F)(F)F
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| InChI |
InChI=1S/C23H29F3N2O/c1-14-19-13-28(12-17-4-2-3-9-29-17)8-7-15(19)10-21-22(14)18-11-16(23(24,25)26)5-6-20(18)27-21/h5-6,11,14-15,17,19,27H,2-4,7-10,12-13H2,1H3
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| InChIKey |
RWRVBLQXKOJFGU-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