General Information of the Compound
| Compound ID |
CP0446917
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| Compound Name |
N-[(4-methylphenyl)methyl]-2,3,4,9-tetrahydro-1H-carbazol-2-amine
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| Structure |
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| Formula |
C20H22N2
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| Molecular Weight |
290.41
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| Canonical SMILES |
Cc1ccc(CNC2CCc3c(C2)[nH]c2ccccc32)cc1
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| InChI |
InChI=1S/C20H22N2/c1-14-6-8-15(9-7-14)13-21-16-10-11-18-17-4-2-3-5-19(17)22-20(18)12-16/h2-9,16,21-22H,10-13H2,1H3
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| InChIKey |
CPAIEIJZVFXFPO-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